ethyl 2-[[(2E)-2-[(5Z)-5-[(4-tert-butylphenyl)methylidene]-3-(2,4-dichlorophenyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-2-cyano-ethanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: ethyl 2-[[(2E)-2-[(5Z)-5-[(4-tert-butylphenyl)methylidene]-3-(2,4-dichlorophenyl)-4-oxidanylidene-1,3-thiazolidin-2-ylidene]-2-cyano-ethanoyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: ethyl 2-[[(2E)-2-[(5Z)-5-[(4-tert-butylphenyl)methylene]-3-(2,4-dichlorophenyl)-4-oxo-thiazolidin-2-ylidene]-2-cyano-acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[[(2E)-2-[(5Z)-5-[(4-tert-butylphenyl)methylidene]-3-(2,4-dichlorophenyl)-4-oxo-2-thiazolidinylidene]-2-cyano-1-oxoethyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[(2E)-2-[(5Z)-5-[(4-tert-butylphenyl)methylidene]-3-(2,4-dichlorophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]-2-cyanoacetyl]amino]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[[(2E)-2-[(5Z)-5-(4-tert-butylbenzylidene)-3-(2,4-dichlorophenyl)-4-keto-thiazolidin-2-ylidene]-2-cyano-acetyl]amino]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid ethyl ester Formula: C34H31Cl2N3O4S2 MolecularWeight: 680.66364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)C(=C3N(C(=O)C(=CC4=CC=C(C=C4)C(C)(C)C)S3)C5=C(C=C(C=C5)Cl)Cl)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC2=C1CCCC2)NC(=O)/C(=C/3\N(C(=O)/C(=C/C4=CC=C(C=C4)C(C)(C)C)/S3)C5=C(C=C(C=C5)Cl)Cl)/C#N

InChI

InChI=1S/C34H31Cl2N3O4S2/c1-5-43-33(42)28-22-8-6-7-9-26(22)44-30(28)38-29(40)23(18-37)32-39(25-15-14-21(35)17-24(25)36)31(41)27(45-32)16-19-10-12-20(13-11-19)34(2,3)4/h10-17H,5-9H2,1-4H3,(H,38,40)/b27-16-,32-23+