4-[4-(1-benzothiophen-4-yl)piperidin-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-one

Systemtic Name: 4-[4-(1-benzothiophen-4-yl)piperidin-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-one Openeye Name: 4-[4-(benzothiophen-4-yl)-1-piperidyl]-1-cyclohexyl-2-(2-pyridyl)butan-1-one CAS Name: 4-[4-(1-benzothiophen-4-yl)-1-piperidinyl]-1-cyclohexyl-2-(2-pyridinyl)-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-4-yl)piperidin-1-yl]-1-cyclohexyl-2-pyridin-2-ylbutan-1-one Traditional Name: 4-[4-(benzothiophen-4-yl)piperidino]-1-cyclohexyl-2-(2-pyridyl)butan-1-one Formula: C28H34N2OS MolecularWeight: 446.64736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C(CCN2CCC(CC2)C3=C4C=CSC4=CC=C3)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)C(=O)C(CCN2CCC(CC2)C3=C4C=CSC4=CC=C3)C5=CC=CC=N5

InChI

InChI=1S/C28H34N2OS/c31-28(22-7-2-1-3-8-22)25(26-10-4-5-16-29-26)14-19-30-17-12-21(13-18-30)23-9-6-11-27-24(23)15-20-32-27/h4-6,9-11,15-16,20-22,25H,1-3,7-8,12-14,17-19H2