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

Systemtic Name: ethyl 2,4-dimethyl-5-[(pyridin-4-ylcarbonylamino)carbamoylamino]-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2,4-dimethyl-5-[(pyridine-4-carbonylamino)carbamoylamino]-1H-pyrrole-3-carboxylate CAS Name: 2,4-dimethyl-5-[[oxo-[[oxo(pyridin-4-yl)methyl]hydrazo]methyl]amino]-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2,4-dimethyl-5-[(pyridine-4-carbonylamino)carbamoylamino]-1H-pyrrole-3-carboxylate Traditional Name: 5-(isonicotinamidocarbamoylamino)-2,4-dimethyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H19N5O4/c1-4-25-15(23)12-9(2)13(18-10(12)3)19-16(24)21-20-14(22)11-5-7-17-8-6-11/h5-8,18H,4H2,1-3H3,(H,20,22)(H2,19,21,24)