2-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[1-[(3-isobutyl-1H-pyrazol-5-yl)methyl]-3-piperidyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]-3-piperidinyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[1-[[3-(2-methylpropyl)-1H-pyrazol-5-yl]methyl]piperidin-3-yl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[1-[(3-isobutyl-1H-pyrazol-5-yl)methyl]-3-piperidyl]-3,4-dihydro-1H-isoquinoline Formula: C22H32N4 MolecularWeight: 352.51628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=NNC(=C1)CN2CCCC(C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC(C)CC1=NNC(=C1)CN2CCCC(C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H32N4/c1-17(2)12-20-13-21(24-23-20)15-25-10-5-8-22(16-25)26-11-9-18-6-3-4-7-19(18)14-26/h3-4,6-7,13,17,22H,5,8-12,14-16H2,1-2H3,(H,23,24)