ethyl 2-ethanoylimino-6-(phenylazanylmethylidene)-7-phenylsulfanyl-4,5-dihydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-ethanoylimino-6-(phenylazanylmethylidene)-7-phenylsulfanyl-4,5-dihydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-acetylimino-6-(anilinomethylene)-7-phenylsulfanyl-4,5-dihydrobenzothiophene-3-carboxylate CAS Name: 2-acetylimino-6-(anilinomethylidene)-7-(phenylthio)-4,5-dihydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-acetylimino-6-(anilinomethylidene)-7-phenylsulfanyl-4,5-dihydro-1-benzothiophene-3-carboxylate Traditional Name: 2-acetylimino-6-(anilinomethylene)-7-(phenylthio)-4,5-dihydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C26H24N2O3S2 MolecularWeight: 476.61036

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2CCC(=CNC3=CC=CC=C3)C(=C2SC1=NC(=O)C)SC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2CCC(=CNC3=CC=CC=C3)C(=C2SC1=NC(=O)C)SC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O3S2/c1-3-31-26(30)22-21-15-14-18(16-27-19-10-6-4-7-11-19)23(32-20-12-8-5-9-13-20)24(21)33-25(22)28-17(2)29/h4-13,16,27H,3,14-15H2,1-2H3