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

Systemtic Name: ethyl 4-methyl-5-[(phenylmethyl)carbamoyl]-2-(thiophen-2-ylcarbonylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-(benzylcarbamoyl)-4-methyl-2-(thiophene-2-carbonylamino)thiophene-3-carboxylate CAS Name: 4-methyl-5-[oxo-[(phenylmethyl)amino]methyl]-2-[[oxo(thiophen-2-yl)methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(benzylcarbamoyl)-4-methyl-2-(thiophene-2-carbonylamino)thiophene-3-carboxylate Traditional Name: 5-(benzylcarbamoyl)-4-methyl-2-(2-thenoylamino)thiophene-3-carboxylic acid ethyl ester Formula: C21H20N2O4S2 MolecularWeight: 428.5245

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NCC2=CC=CC=C2)NC(=O)C3=CC=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NCC2=CC=CC=C2)NC(=O)C3=CC=CS3

InChI

InChI=1S/C21H20N2O4S2/c1-3-27-21(26)16-13(2)17(19(25)22-12-14-8-5-4-6-9-14)29-20(16)23-18(24)15-10-7-11-28-15/h4-11H,3,12H2,1-2H3,(H,22,25)(H,23,24)