ethyl 2-[[2-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanoyl]amino]-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-[[2-(3-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-ethanoyl]amino]-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(3-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenyl-acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[2-[(3-methyl-4-oxo-5-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxo-2-phenylethyl]amino]-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(3-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanyl-2-phenylacetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 2-[[2-[(4-keto-3-methyl-5-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]-2-phenyl-acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C34H27N3O4S3 MolecularWeight: 637.79088

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=NC5=C(C(=CS5)C6=CC=CC=C6)C(=O)N4C

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC(=O)C(C3=CC=CC=C3)SC4=NC5=C(C(=CS5)C6=CC=CC=C6)C(=O)N4C

InChI

InChI=1S/C34H27N3O4S3/c1-3-41-33(40)27-25(22-15-9-5-10-16-22)20-43-31(27)35-29(38)28(23-17-11-6-12-18-23)44-34-36-30-26(32(39)37(34)2)24(19-42-30)21-13-7-4-8-14-21/h4-20,28H,3H2,1-2H3,(H,35,38)