N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[3-(3-azanyl-4-cyano-1H-pyrazol-5-yl)propyl]-3-(4-chlorophenyl)-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzyl-3-(4-chlorophenyl)pyrazole-4-carboxamide CAS Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-3-(4-chlorophenyl)-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzyl-3-(4-chlorophenyl)pyrazole-4-carboxamide Traditional Name: N-[3-(3-amino-4-cyano-1H-pyrazol-5-yl)propyl]-1-benzyl-3-(4-chlorophenyl)pyrazole-4-carboxamide Formula: C24H22ClN7O MolecularWeight: 459.93078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(C=C3)Cl)C(=O)NCCCC4=C(C(=NN4)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(C(=N2)C3=CC=C(C=C3)Cl)C(=O)NCCCC4=C(C(=NN4)N)C#N

InChI

InChI=1S/C24H22ClN7O/c25-18-10-8-17(9-11-18)22-20(15-32(31-22)14-16-5-2-1-3-6-16)24(33)28-12-4-7-21-19(13-26)23(27)30-29-21/h1-3,5-6,8-11,15H,4,7,12,14H2,(H,28,33)(H3,27,29,30)