(3,5-diphenyl-3,4-dihydropyrazol-2-yl)-[4-(phenylmethyl)piperidin-1-yl]methanethione

Systemtic Name: (3,5-diphenyl-3,4-dihydropyrazol-2-yl)-[4-(phenylmethyl)piperidin-1-yl]methanethione Openeye Name: (4-benzyl-1-piperidyl)-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)methanethione CAS Name: (3,5-diphenyl-3,4-dihydropyrazol-2-yl)-[4-(phenylmethyl)-1-piperidinyl]methanethione IUPAC Name: (4-benzylpiperidin-1-yl)-(3,5-diphenyl-3,4-dihydropyrazol-2-yl)methanethione Traditional Name: (4-benzylpiperidino)-(3,5-diphenyl-2-pyrazolin-1-yl)methanethione Formula: C28H29N3S MolecularWeight: 439.61496

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=S)N3C(CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=S)N3C(CC(=N3)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C28H29N3S/c32-28(30-18-16-23(17-19-30)20-22-10-4-1-5-11-22)31-27(25-14-8-3-9-15-25)21-26(29-31)24-12-6-2-7-13-24/h1-15,23,27H,16-21H2