5-(4-chlorophenyl)-N-cyano-4-(4-methyl-2-oxidanylidene-piperazin-1-yl)-N'-phenethyl-3,4-dihydropyrazole-2-carboximidamide

Systemtic Name: 5-(4-chlorophenyl)-N-cyano-4-(4-methyl-2-oxidanylidene-piperazin-1-yl)-N'-phenethyl-3,4-dihydropyrazole-2-carboximidamide Openeye Name: 5-(4-chlorophenyl)-N-cyano-4-(4-methyl-2-oxo-piperazin-1-yl)-N'-phenethyl-3,4-dihydropyrazole-2-carboxamidine CAS Name: 5-(4-chlorophenyl)-N-cyano-4-(4-methyl-2-oxo-1-piperazinyl)-N'-phenethyl-3,4-dihydropyrazole-2-carboximidamide IUPAC Name: 5-(4-chlorophenyl)-N-cyano-4-(4-methyl-2-oxopiperazin-1-yl)-N'-phenethyl-3,4-dihydropyrazole-2-carboximidamide Traditional Name: 3-(4-chlorophenyl)-N-cyano-4-(2-keto-4-methyl-piperazino)-N'-phenethyl-2-pyrazoline-1-carboxamidine Formula: C24H26ClN7O MolecularWeight: 463.96254

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(C(=O)C1)C2CN(N=C2C3=CC=C(C=C3)Cl)C(=NCCC4=CC=CC=C4)NC#N

Isomeric SMILES

CN1CCN(C(=O)C1)C2CN(N=C2C3=CC=C(C=C3)Cl)C(=NCCC4=CC=CC=C4)NC#N

InChI

InChI=1S/C24H26ClN7O/c1-30-13-14-31(22(33)16-30)21-15-32(29-23(21)19-7-9-20(25)10-8-19)24(28-17-26)27-12-11-18-5-3-2-4-6-18/h2-10,21H,11-16H2,1H3,(H,27,28)