diethyl 5-[1-[(3-cyano-5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[1-[(3-cyano-5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanyl-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[2-[(3-cyano-5-ethoxycarbonyl-4-methyl-2-thienyl)amino]-1-methyl-2-oxo-ethyl]sulfanyl-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[1-[(3-cyano-5-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-1-oxopropan-2-yl]thio]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[1-[(3-cyano-5-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-1-oxopropan-2-yl]sulfanyl-3-methylthiophene-2,4-dicarboxylate Traditional Name: 5-[[2-[(5-carbethoxy-3-cyano-4-methyl-2-thienyl)amino]-2-keto-1-methyl-ethyl]thio]-3-methyl-thiophene-2,4-dicarboxylic acid diethyl ester Formula: C23H26N2O7S3 MolecularWeight: 538.65674

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)SC(C)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)SC(C)C(=O)NC2=C(C(=C(S2)C(=O)OCC)C)C#N

InChI

InChI=1S/C23H26N2O7S3/c1-7-30-20(27)15-12(5)17(22(29)32-9-3)35-23(15)33-13(6)18(26)25-19-14(10-24)11(4)16(34-19)21(28)31-8-2/h13H,7-9H2,1-6H3,(H,25,26)