ethyl 2,4-dimethyl-5-[(phenylmethyl)carbamoylamino]-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2,4-dimethyl-5-[(phenylmethyl)carbamoylamino]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 5-(benzylcarbamoylamino)-2,4-dimethyl-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[oxo-[(phenylmethyl)amino]methyl]amino]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(benzylcarbamoylamino)-2,4-dimethyl-1H-pyrrole-3-carboxylate Traditional Name: 5-(benzylcarbamoylamino)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21N3O3/c1-4-23-16(21)14-11(2)15(19-12(14)3)20-17(22)18-10-13-8-6-5-7-9-13/h5-9,19H,4,10H2,1-3H3,(H2,18,20,22)