(phenylmethyl) 5-methyl-4-[(phenylmethyl)carbamoylamino]thiophene-2-carboxylate

Systemtic Name: (phenylmethyl) 5-methyl-4-[(phenylmethyl)carbamoylamino]thiophene-2-carboxylate Openeye Name: benzyl 4-(benzylcarbamoylamino)-5-methyl-thiophene-2-carboxylate CAS Name: 5-methyl-4-[[oxo-[(phenylmethyl)amino]methyl]amino]-2-thiophenecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-(benzylcarbamoylamino)-5-methylthiophene-2-carboxylate Traditional Name: 4-(benzylcarbamoylamino)-5-methyl-thiophene-2-carboxylic acid benzyl ester Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(S1)C(=O)OCC2=CC=CC=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(S1)C(=O)OCC2=CC=CC=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2O3S/c1-15-18(23-21(25)22-13-16-8-4-2-5-9-16)12-19(27-15)20(24)26-14-17-10-6-3-7-11-17/h2-12H,13-14H2,1H3,(H2,22,23,25)