1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-(2-methylpropyl)pyrazole-4-carboxamide

Systemtic Name: 1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-(2-methylpropyl)pyrazole-4-carboxamide Openeye Name: 1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-isobutyl-pyrazole-4-carboxamide CAS Name: 1-[[4-[(2-aminoanilino)-oxomethyl]phenyl]methyl]-N-(2-methylpropyl)-4-pyrazolecarboxamide IUPAC Name: 1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-(2-methylpropyl)pyrazole-4-carboxamide Traditional Name: 1-[4-[(2-aminophenyl)carbamoyl]benzyl]-N-isobutyl-pyrazole-4-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

Isomeric SMILES

CC(C)CNC(=O)C1=CN(N=C1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3N

InChI

InChI=1S/C22H25N5O2/c1-15(2)11-24-21(28)18-12-25-27(14-18)13-16-7-9-17(10-8-16)22(29)26-20-6-4-3-5-19(20)23/h3-10,12,14-15H,11,13,23H2,1-2H3,(H,24,28)(H,26,29)