methyl 5-methyl-4-phenyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-4-phenyl-2-(2-phenylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-methyl-4-phenyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[1-oxo-2-(phenylthio)ethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-4-phenyl-2-[(2-phenylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-methyl-4-phenyl-2-[[2-(phenylthio)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H19NO3S2 MolecularWeight: 397.51046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CSC2=CC=CC=C2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CSC2=CC=CC=C2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H19NO3S2/c1-14-18(15-9-5-3-6-10-15)19(21(24)25-2)20(27-14)22-17(23)13-26-16-11-7-4-8-12-16/h3-12H,13H2,1-2H3,(H,22,23)