methyl 2-methyl-4-propyl-5-[[4-(1H-pyrazol-5-yl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate

Systemtic Name: methyl 2-methyl-4-propyl-5-[[4-(1H-pyrazol-5-yl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate Openeye Name: methyl 2-methyl-4-propyl-5-[[4-(1H-pyrazol-5-yl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate CAS Name: 2-methyl-5-[oxo-[[4-(1H-pyrazol-5-yl)phenyl]methylamino]methyl]-4-propyl-1H-pyrrole-3-carboxylic acid methyl ester IUPAC Name: methyl 2-methyl-4-propyl-5-[[4-(1H-pyrazol-5-yl)phenyl]methylcarbamoyl]-1H-pyrrole-3-carboxylate Traditional Name: 2-methyl-4-propyl-5-[[4-(1H-pyrazol-5-yl)benzyl]carbamoyl]-1H-pyrrole-3-carboxylic acid methyl ester Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1C(=O)OC)C)C(=O)NCC2=CC=C(C=C2)C3=CC=NN3

Isomeric SMILES

CCCC1=C(NC(=C1C(=O)OC)C)C(=O)NCC2=CC=C(C=C2)C3=CC=NN3

InChI

InChI=1S/C21H24N4O3/c1-4-5-16-18(21(27)28-3)13(2)24-19(16)20(26)22-12-14-6-8-15(9-7-14)17-10-11-23-25-17/h6-11,24H,4-5,12H2,1-3H3,(H,22,26)(H,23,25)