[5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone

Systemtic Name: [5-chloranyl-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Openeye Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-[4-(3-methoxyphenyl)piperazin-1-yl]methanone CAS Name: [5-chloro-3-methyl-1-(2-methylpropyl)-4-pyrazolyl]-[4-(3-methoxyphenyl)-1-piperazinyl]methanone IUPAC Name: [5-chloro-3-methyl-1-(2-methylpropyl)pyrazol-4-yl]-[4-(3-methoxyphenyl)piperazin-1-yl]methanone Traditional Name: (5-chloro-1-isobutyl-3-methyl-pyrazol-4-yl)-[4-(3-methoxyphenyl)piperazino]methanone Formula: C20H27ClN4O2 MolecularWeight: 390.90698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C(=O)N2CCN(CC2)C3=CC(=CC=C3)OC)Cl)CC(C)C

Isomeric SMILES

CC1=NN(C(=C1C(=O)N2CCN(CC2)C3=CC(=CC=C3)OC)Cl)CC(C)C

InChI

InChI=1S/C20H27ClN4O2/c1-14(2)13-25-19(21)18(15(3)22-25)20(26)24-10-8-23(9-11-24)16-6-5-7-17(12-16)27-4/h5-7,12,14H,8-11,13H2,1-4H3