[(3S)-3-[4-(2-methylphenyl)piperazin-1-yl]piperidin-1-yl]-(5-propan-2-yl-1H-pyrazol-3-yl)methanone

Systemtic Name: [(3S)-3-[4-(2-methylphenyl)piperazin-1-yl]piperidin-1-yl]-(5-propan-2-yl-1H-pyrazol-3-yl)methanone Openeye Name: (5-isopropyl-1H-pyrazol-3-yl)-[(3S)-3-[4-(o-tolyl)piperazin-1-yl]-1-piperidyl]methanone CAS Name: [(3S)-3-[4-(2-methylphenyl)-1-piperazinyl]-1-piperidinyl]-(5-propan-2-yl-1H-pyrazol-3-yl)methanone IUPAC Name: [(3S)-3-[4-(2-methylphenyl)piperazin-1-yl]piperidin-1-yl]-(5-propan-2-yl-1H-pyrazol-3-yl)methanone Traditional Name: (5-isopropyl-1H-pyrazol-3-yl)-[(3S)-3-[4-(o-tolyl)piperazino]piperidino]methanone Formula: C23H33N5O MolecularWeight: 395.54102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CCN(CC2)C3CCCN(C3)C(=O)C4=NNC(=C4)C(C)C

Isomeric SMILES

CC1=CC=CC=C1N2CCN(CC2)[C@H]3CCCN(C3)C(=O)C4=NNC(=C4)C(C)C

InChI

InChI=1S/C23H33N5O/c1-17(2)20-15-21(25-24-20)23(29)28-10-6-8-19(16-28)26-11-13-27(14-12-26)22-9-5-4-7-18(22)3/h4-5,7,9,15,17,19H,6,8,10-14,16H2,1-3H3,(H,24,25)/t19-/m0/s1