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

Systemtic Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-(2-phenylsulfanylethanoylamino)thiophene-2-carboxylate Openeye Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-[(2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate CAS Name: 3-methyl-4-(methylcarbamoyl)-5-[[1-oxo-2-(phenylthio)ethyl]amino]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-(methylcarbamoyl)-5-[(2-phenylsulfanylacetyl)amino]thiophene-2-carboxylate Traditional Name: 3-methyl-4-(methylcarbamoyl)-5-[[2-(phenylthio)acetyl]amino]thiophene-2-carboxylic acid ethyl ester Formula: C18H20N2O4S2 MolecularWeight: 392.4924

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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)NC)C

Isomeric SMILES

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

InChI

InChI=1S/C18H20N2O4S2/c1-4-24-18(23)15-11(2)14(16(22)19-3)17(26-15)20-13(21)10-25-12-8-6-5-7-9-12/h5-9H,4,10H2,1-3H3,(H,19,22)(H,20,21)