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

Systemtic Name: 4-[4-(1-benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-pyridin-2-yl-butan-1-one Openeye Name: 4-[4-(benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-(2-pyridyl)butan-1-one CAS Name: 4-[4-(1-benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-(2-pyridinyl)-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cyclohexyl-2-pyridin-2-ylbutan-1-one Traditional Name: 4-[4-(benzothiophen-6-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=CC4=C(C=C3)C=CS4)C5=CC=CC=N5

Isomeric SMILES

C1CCC(CC1)C(=O)C(CCN2CCC(=CC2)C3=CC4=C(C=C3)C=CS4)C5=CC=CC=N5

InChI

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