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

Systemtic Name: 4-[4-(1-benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-pyridin-2-yl-butan-1-one Openeye Name: 4-[4-(benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-(2-pyridyl)butan-1-one CAS Name: 4-[4-(1-benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-(2-pyridinyl)-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-pyridin-2-ylbutan-1-one Traditional Name: 4-[4-(benzothiophen-6-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-(2-pyridyl)butan-1-one Formula: C29H34N2OS MolecularWeight: 458.65806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C(=O)C(CCN2CCC(=CC2)C3=CC4=C(C=C3)C=CS4)C5=CC=CC=N5

Isomeric SMILES

C1CCCC(CC1)C(=O)C(CCN2CCC(=CC2)C3=CC4=C(C=C3)C=CS4)C5=CC=CC=N5

InChI

InChI=1S/C29H34N2OS/c32-29(24-7-3-1-2-4-8-24)26(27-9-5-6-16-30-27)14-19-31-17-12-22(13-18-31)25-11-10-23-15-20-33-28(23)21-25/h5-6,9-12,15-16,20-21,24,26H,1-4,7-8,13-14,17-19H2