propan-2-yl 2,4-dimethyl-5-[(pyridin-3-ylcarbonylamino)carbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: propan-2-yl 2,4-dimethyl-5-[(pyridin-3-ylcarbonylamino)carbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: isopropyl 2,4-dimethyl-5-[(pyridine-3-carbonylamino)carbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[oxo-[[oxo(3-pyridinyl)methyl]hydrazo]methyl]-1H-pyrrole-3-carboxylic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,4-dimethyl-5-[(pyridine-3-carbonylamino)carbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2,4-dimethyl-5-(nicotinamidocarbamoyl)-1H-pyrrole-3-carboxylic acid isopropyl ester Formula: C17H20N4O4 MolecularWeight: 344.3651

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NNC(=O)C2=CN=CC=C2

Isomeric SMILES

CC1=C(NC(=C1C(=O)OC(C)C)C)C(=O)NNC(=O)C2=CN=CC=C2

InChI

InChI=1S/C17H20N4O4/c1-9(2)25-17(24)13-10(3)14(19-11(13)4)16(23)21-20-15(22)12-6-5-7-18-8-12/h5-9,19H,1-4H3,(H,20,22)(H,21,23)