(1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone

Systemtic Name: (1-butyl-5-chloranyl-3-methyl-pyrazol-4-yl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Openeye Name: (1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone CAS Name: (1-butyl-5-chloro-3-methyl-4-pyrazolyl)-[4-(2,3-dimethylphenyl)-1-piperazinyl]methanone IUPAC Name: (1-butyl-5-chloro-3-methylpyrazol-4-yl)-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone Traditional Name: (1-butyl-5-chloro-3-methyl-pyrazol-4-yl)-[4-(2,3-dimethylphenyl)piperazino]methanone Formula: C21H29ClN4O MolecularWeight: 388.93416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=C(C(=N1)C)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)Cl

Isomeric SMILES

CCCCN1C(=C(C(=N1)C)C(=O)N2CCN(CC2)C3=CC=CC(=C3C)C)Cl

InChI

InChI=1S/C21H29ClN4O/c1-5-6-10-26-20(22)19(17(4)23-26)21(27)25-13-11-24(12-14-25)18-9-7-8-15(2)16(18)3/h7-9H,5-6,10-14H2,1-4H3