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

Systemtic Name: 1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-(2-piperazin-1-ylethyl)pyrazole-4-carboxamide Openeye Name: 1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-(2-piperazin-1-ylethyl)pyrazole-4-carboxamide CAS Name: 1-[[4-[(2-aminoanilino)-oxomethyl]phenyl]methyl]-N-[2-(1-piperazinyl)ethyl]-4-pyrazolecarboxamide IUPAC Name: 1-[[4-[(2-aminophenyl)carbamoyl]phenyl]methyl]-N-(2-piperazin-1-ylethyl)pyrazole-4-carboxamide Traditional Name: 1-[4-[(2-aminophenyl)carbamoyl]benzyl]-N-(2-piperazinoethyl)pyrazole-4-carboxamide Formula: C24H29N7O2 MolecularWeight: 447.53276

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)CCNC(=O)C2=CN(N=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

Isomeric SMILES

C1CN(CCN1)CCNC(=O)C2=CN(N=C2)CC3=CC=C(C=C3)C(=O)NC4=CC=CC=C4N

InChI

InChI=1S/C24H29N7O2/c25-21-3-1-2-4-22(21)29-24(33)19-7-5-18(6-8-19)16-31-17-20(15-28-31)23(32)27-11-14-30-12-9-26-10-13-30/h1-8,15,17,26H,9-14,16,25H2,(H,27,32)(H,29,33)