4-[4-(1-benzothiophen-7-yl)-2,2-dimethyl-piperidin-1-yl]-1-cyclohexyl-2-methyl-2-pyridin-2-yl-butan-1-one

Systemtic Name: 4-[4-(1-benzothiophen-7-yl)-2,2-dimethyl-piperidin-1-yl]-1-cyclohexyl-2-methyl-2-pyridin-2-yl-butan-1-one Openeye Name: 4-[4-(benzothiophen-7-yl)-2,2-dimethyl-1-piperidyl]-1-cyclohexyl-2-methyl-2-(2-pyridyl)butan-1-one CAS Name: 4-[4-(1-benzothiophen-7-yl)-2,2-dimethyl-1-piperidinyl]-1-cyclohexyl-2-methyl-2-(2-pyridinyl)-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-7-yl)-2,2-dimethylpiperidin-1-yl]-1-cyclohexyl-2-methyl-2-pyridin-2-ylbutan-1-one Traditional Name: 4-[4-(benzothiophen-7-yl)-2,2-dimethyl-piperidino]-1-cyclohexyl-2-methyl-2-(2-pyridyl)butan-1-one Formula: C31H40N2OS MolecularWeight: 488.7271

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(CCN1CCC(C)(C2=CC=CC=N2)C(=O)C3CCCCC3)C4=CC=CC5=C4SC=C5)C

Isomeric SMILES

CC1(CC(CCN1CCC(C)(C2=CC=CC=N2)C(=O)C3CCCCC3)C4=CC=CC5=C4SC=C5)C

InChI

InChI=1S/C31H40N2OS/c1-30(2)22-25(26-13-9-12-23-16-21-35-28(23)26)15-19-33(30)20-17-31(3,27-14-7-8-18-32-27)29(34)24-10-5-4-6-11-24/h7-9,12-14,16,18,21,24-25H,4-6,10-11,15,17,19-20,22H2,1-3H3