(5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]methanone

Systemtic Name: (5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]methanone Openeye Name: (5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]methanone CAS Name: (5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)-[(3S,5R)-3,4,5-trimethyl-1-piperazinyl]methanone IUPAC Name: (5-pentyl-4-phenyl-3,4-dihydropyrazol-2-yl)-[(3S,5R)-3,4,5-trimethylpiperazin-1-yl]methanone Traditional Name: (3-amyl-4-phenyl-2-pyrazolin-1-yl)-[(3S,5R)-3,4,5-trimethylpiperazino]methanone Formula: C22H34N4O MolecularWeight: 370.53156

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NN(CC1C2=CC=CC=C2)C(=O)N3CC(N(C(C3)C)C)C

Isomeric SMILES

CCCCCC1=NN(CC1C2=CC=CC=C2)C(=O)N3C[C@H](N([C@H](C3)C)C)C

InChI

InChI=1S/C22H34N4O/c1-5-6-8-13-21-20(19-11-9-7-10-12-19)16-26(23-21)22(27)25-14-17(2)24(4)18(3)15-25/h7,9-12,17-18,20H,5-6,8,13-16H2,1-4H3/t17-,18+,20?