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

Systemtic Name: ethyl 4-aminocarbonyl-3-methyl-5-(2-phenylsulfanylethanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 4-carbamoyl-3-methyl-5-[(2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate CAS Name: 4-carbamoyl-3-methyl-5-[[1-oxo-2-(phenylthio)ethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-carbamoyl-3-methyl-5-[(2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate Traditional Name: 4-carbamoyl-3-methyl-5-[[2-(phenylthio)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C17H18N2O4S2 MolecularWeight: 378.46582

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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)N)C

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O4S2/c1-3-23-17(22)14-10(2)13(15(18)21)16(25-14)19-12(20)9-24-11-7-5-4-6-8-11/h4-8H,3,9H2,1-2H3,(H2,18,21)(H,19,20)