Chem
J-GLOBAL ID:200907057806643477
Nikkaji number:J2.099.151H
2′-Thioxo-3′-ethyl-4,4′-dioxo-5-[4-[4-(2,2-diphenylethenyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole-7-ylmethylene]-Δ2,5′ -bithiazolidine-3-propionic acid
2′-チオキソ-3′-エチル-4,4′-ジオキソ-5-[4-[4-(2,2-ジフェニルエテニル)フェニル]-1,2,3,3a,4,8b-ヘキサヒドロシクロペンタ[b]インドール-7-イルメチレン]-Δ2,5′ -ビチアゾリジン-3-プロピオン酸
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Substance type:
Substance type
Substance type classified into 3 categories. Decided structure: Substances with a clear structure Undicided Structure: Substances with unknown or undetermined structure Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula:
C43 H37 N3 O4 S3
Molecular formula furigana:
C43-H37-N3-O4-S3
Molecular weight:
755.970
InChI:
InChI=1S/C43H37N3O4S3/c1-2-44-41(50)39(53-43(44)51)42-45(23-22-38(47)48)40(49)37(52-42)26-28-18-21-36-34(25-28)32-14-9-15-35(32)46(36)31-19-16-27(17-20-31)24-33(29-10-5-3-6-11-29)30-12-7-4-8-13-30/h3-8,10-13,16-21,24-26,32,35H,2,9,14-15,22-23H2,1H3,(H,47,48)
InChI key:
SOUYTRKPOQAXHS-UHFFFAOYSA-N
SMILES:
CCN1C(=S)SC(=c2sc(=Cc3ccc4N(C5CCCC5c4c3)c3ccc(C=C(c4ccccc4)c4ccccc4)cc3)c(=O)n2CCC(=O)O)C1=O
Systematic name (3):
2′-チオキソ-3′-エチル-4,4′-ジオキソ-5-[4-[4-(2,2-ジフェニルエテニル)フェニル]-1,2,3,3a,4,8b-ヘキサヒドロシクロペンタ[b]インドール-7-イルメチレン]-Δ2,5′ -ビチアゾリジン-3-プロピオン酸
3-[5-({4-[4-(2,2-ジフェニルエテニル)フェニル]-1H,2H,3H,3aH,4H,8bH-シクロペンタ[b]インドール-7-イル}メチリデン)-2-(3-エチル-4-オキソ-2-スルファニリデン-1,3-チアゾリジン-5-イリデン)-4-オキソ-1,3-チアゾリジン-3-イル]プロパン酸
3-[5-({4-[4-(2,2-diphenylethenyl)phenyl]-1H,2H,3H,3aH,4H,8bH-cyclopenta[b]indol-7-yl}methylidene)-2-(3-ethyl-4-oxo-2-sulfanylidene-1,3-thiazolidin-5-ylidene)-4-oxo-1,3-thiazolidin-3-yl]propanoic acid
Other name (1):
2′-Thioxo-3′-ethyl-4,4′-dioxo-5-[4-[4-(2,2-diphenylethenyl)phenyl]-1,2,3,3a,4,8b-hexahydrocyclopenta[b]indole-7-ylmethylene]-Δ2,5′ -bithiazolidine-3-propionic acid
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