Chem
J-GLOBAL ID:200907057954798358
Nikkaji number:J2.517.736C
3-[6-(1,2,3,4-Tetrahydro-1,2,2,4-tetramethylquinoline-6-yl)-dithieno[3,2-b:2′,3′-d]thiophene-2-yl]-2-cyanoacrylic acid
3-[6-(1,2,3,4-テトラヒドロ-1,2,2,4-テトラメチルキノリン-6-イル)-ジチエノ[3,2-b:2′,3′-d]チオフェン-2-イル]-2-シアノアクリル酸
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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:
C25 H22 N2 O2 S3
Molecular formula furigana:
C25-H22-N2-O2-S3
Molecular weight:
478.640
InChI:
InChI=1S/C25H22N2O2S3/c1-13-11-25(2,3)27(4)18-6-5-14(8-17(13)18)19-10-21-23(32-19)22-20(31-21)9-16(30-22)7-15(12-26)24(28)29/h5-10,13H,11H2,1-4H3,(H,28,29)
InChI key:
DPRMRJUOMQZMMM-UHFFFAOYSA-N
SMILES:
CC1CC(C)(C)N(C)c2ccc(cc12)c1cc2sc3cc(C=C(C#N)C(=O)O)sc3c2s1
Systematic name (3):
3-[6-(1,2,3,4-テトラヒドロ-1,2,2,4-テトラメチルキノリン-6-イル)-ジチエノ[3,2-b:2′,3′-d]チオフェン-2-イル]-2-シアノアクリル酸
2-シアノ-3-[10-(1,2,2,4-テトラメチル-1,2,3,4-テトラヒドロキノリン-6-イル)-3,7,11-トリチアトリシクロ[6.3.0.02,6 ]ウンデカ-1(8),2(6),4,9-テトラエン-4-イル]プロパ-2-エン酸
2-cyano-3-[10-(1,2,2,4-tetramethyl-1,2,3,4-tetrahydroquinolin-6-yl)-3,7,11-trithiatricyclo[6.3.0.02,6 ]undeca-1(8),2(6),4,9-tetraen-4-yl]prop-2-enoic acid
Other name (1):
3-[6-(1,2,3,4-Tetrahydro-1,2,2,4-tetramethylquinoline-6-yl)-dithieno[3,2-b:2′,3′-d]thiophene-2-yl]-2-cyanoacrylic acid
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