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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(NC(=C1C(=O)OC)C)C(=O)NCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

CCCC1=C(NC(=C1C(=O)OC)C)C(=O)NCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C21H24N4O3/c1-4-6-17-18(21(27)28-3)14(2)24-19(17)20(26)22-13-15-7-9-16(10-8-15)25-12-5-11-23-25/h5,7-12,24H,4,6,13H2,1-3H3,(H,22,26)