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

Systemtic Name: 4-[4-(1-benzothiophen-4-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-pyridin-2-yl-butan-1-one Openeye Name: 4-[4-(benzothiophen-4-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-(2-pyridyl)butan-1-one CAS Name: 4-[4-(1-benzothiophen-4-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-(2-pyridinyl)-1-butanone IUPAC Name: 4-[4-(1-benzothiophen-4-yl)-3,6-dihydro-2H-pyridin-1-yl]-1-cycloheptyl-2-pyridin-2-ylbutan-1-one Traditional Name: 4-[4-(benzothiophen-4-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=C4C=CSC4=CC=C3)C5=CC=CC=N5

Isomeric SMILES

C1CCCC(CC1)C(=O)C(CCN2CCC(=CC2)C3=C4C=CSC4=CC=C3)C5=CC=CC=N5

InChI

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