ethyl 3-methyl-4-(phenylcarbamoyl)-5-(2-phenylsulfanylethanoylamino)thiophene-2-carboxylate

Systemtic Name: ethyl 3-methyl-4-(phenylcarbamoyl)-5-(2-phenylsulfanylethanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-4-(phenylcarbamoyl)-5-[(2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate CAS Name: 4-[anilino(oxo)methyl]-3-methyl-5-[[1-oxo-2-(phenylthio)ethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(phenylcarbamoyl)-5-[(2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-4-(phenylcarbamoyl)-5-[[2-(phenylthio)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C23H22N2O4S2 MolecularWeight: 454.56178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(S1)NC(=O)CSC2=CC=CC=C2)C(=O)NC3=CC=CC=C3)C

InChI

InChI=1S/C23H22N2O4S2/c1-3-29-23(28)20-15(2)19(21(27)24-16-10-6-4-7-11-16)22(31-20)25-18(26)14-30-17-12-8-5-9-13-17/h4-13H,3,14H2,1-2H3,(H,24,27)(H,25,26)