4-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-one

Systemtic Name: 4-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-one Openeye Name: 4-[4-(benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-(2-pyridyl)butan-1-one CAS Name: 4-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-(2-pyridinyl)-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-pyridin-2-ylbutan-1-one Traditional Name: 4-[4-(benzothiophen-7-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-(2-pyridyl)butan-1-one Formula: C28H32N2OS MolecularWeight: 444.63148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)C(CCN2CCC(=CC2)C3=CC=CC4=C3SC=C4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)C(=O)C(CCN2CCC(=CC2)C3=CC=CC4=C3SC=C4)C5=CC=CC=N5

InChI

InChI=1S/C28H32N2OS/c31-27(22-7-2-1-3-8-22)25(26-11-4-5-16-29-26)14-19-30-17-12-21(13-18-30)24-10-6-9-23-15-20-32-28(23)24/h4-6,9-12,15-16,20,22,25H,1-3,7-8,13-14,17-19H2