1-[3-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidin-1-yl]-2-thiophen-2-yl-ethanone

Systemtic Name: 1-[3-phenyl-5-[4-(phenylmethyl)piperazin-1-yl]carbonyl-piperidin-1-yl]-2-thiophen-2-yl-ethanone Openeye Name: 1-[3-(4-benzylpiperazine-1-carbonyl)-5-phenyl-1-piperidyl]-2-(2-thienyl)ethanone CAS Name: 1-[3-[oxo-[4-(phenylmethyl)-1-piperazinyl]methyl]-5-phenyl-1-piperidinyl]-2-thiophen-2-ylethanone IUPAC Name: 1-[3-(4-benzylpiperazine-1-carbonyl)-5-phenylpiperidin-1-yl]-2-thiophen-2-ylethanone Traditional Name: 1-[3-(4-benzylpiperazine-1-carbonyl)-5-phenyl-piperidino]-2-(2-thienyl)ethanone Formula: C29H33N3O2S MolecularWeight: 487.65622

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3CC(CN(C3)C(=O)CC4=CC=CS4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)C3CC(CN(C3)C(=O)CC4=CC=CS4)C5=CC=CC=C5

InChI

InChI=1S/C29H33N3O2S/c33-28(19-27-12-7-17-35-27)32-21-25(24-10-5-2-6-11-24)18-26(22-32)29(34)31-15-13-30(14-16-31)20-23-8-3-1-4-9-23/h1-12,17,25-26H,13-16,18-22H2