methyl 4-methyl-5-[(phenylmethyl)carbamoyl]-2-(2-thiophen-2-ylethanoylamino)thiophene-3-carboxylate

Systemtic Name: methyl 4-methyl-5-[(phenylmethyl)carbamoyl]-2-(2-thiophen-2-ylethanoylamino)thiophene-3-carboxylate Openeye Name: methyl 5-(benzylcarbamoyl)-4-methyl-2-[[2-(2-thienyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-[oxo-[(phenylmethyl)amino]methyl]-2-[(1-oxo-2-thiophen-2-ylethyl)amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(benzylcarbamoyl)-4-methyl-2-[(2-thiophen-2-ylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-(benzylcarbamoyl)-4-methyl-2-[[2-(2-thienyl)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C21H20N2O4S2 MolecularWeight: 428.5245

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=CS2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CC2=CC=CS2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O4S2/c1-13-17(21(26)27-2)20(23-16(24)11-15-9-6-10-28-15)29-18(13)19(25)22-12-14-7-4-3-5-8-14/h3-10H,11-12H2,1-2H3,(H,22,25)(H,23,24)