Chem
J-GLOBAL ID:201007024459007617
Nikkaji number:J2.794.671B
2-[(4Z)-7-Acetyl-8-methyl-4H-5,6-dithia-8b-aza-as-indacene-4-ylidene]succinic acid dimethyl ester
2-[(4Z)-7-アセチル-8-メチル-4H-5,6-ジチア-8b-アザ-as-インダセン-4-イリデン]こはく酸ジメチル
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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:
C18 H17 NO5 S2
Molecular formula furigana:
C18-H17-N-O5-S2
Molecular weight:
391.460
InChI:
InChI=1S/C18H17NO5S2/c1-9-14-18(25-15(9)10(2)20)26-16(12-6-5-7-19(12)14)11(17(22)24-4)8-13(21)23-3/h5-7H,8H2,1-4H3/b16-11-
InChI key:
ZHWQGFVPAHTLAC-WJDWOHSUSA-N
SMILES:
COC(=O)C/C(=c\1/sc2sc(C(=O)C)c(C)c2n2cccc12)/C(=O)OC
Systematic name (3):
2-[(4Z)-7-アセチル-8-メチル-4H-5,6-ジチア-8b-アザ-as-インダセン-4-イリデン]こはく酸ジメチル
1,4-ジメチル 2-[(8Z)-4-アセチル-3-メチル-5,7-ジチア-1-アザトリシクロ[7.3.0.02,6 ]ドデカ-2(6),3,9,11-テトラエン-8-イリデン]ブタンジオアート
1,4-dimethyl 2-[(8Z)-4-acetyl-3-methyl-5,7-dithia-1-azatricyclo[7.3.0.02,6 ]dodeca-2(6),3,9,11-tetraen-8-ylidene]butanedioate
Other name (1):
2-[(4Z)-7-Acetyl-8-methyl-4H-5,6-dithia-8b-aza-as-indacene-4-ylidene]succinic acid dimethyl ester
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