4-[3-(1-benzothiophen-7-yl)pyrrolidin-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one

Systemtic Name: 4-[3-(1-benzothiophen-7-yl)pyrrolidin-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one Openeye Name: 4-[3-(benzothiophen-7-yl)pyrrolidin-1-yl]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one CAS Name: 4-[3-(1-benzothiophen-7-yl)-1-pyrrolidinyl]-1-cyclohexyl-2-methyl-2-phenyl-1-butanone IUPAC Name: 4-[3-(1-benzothiophen-7-yl)pyrrolidin-1-yl]-1-cyclohexyl-2-methyl-2-phenylbutan-1-one Traditional Name: 4-[3-(benzothiophen-7-yl)pyrrolidino]-1-cyclohexyl-2-methyl-2-phenyl-butan-1-one Formula: C29H35NOS MolecularWeight: 445.6593

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCN1CCC(C1)C2=CC=CC3=C2SC=C3)(C4=CC=CC=C4)C(=O)C5CCCCC5

Isomeric SMILES

CC(CCN1CCC(C1)C2=CC=CC3=C2SC=C3)(C4=CC=CC=C4)C(=O)C5CCCCC5

InChI

InChI=1S/C29H35NOS/c1-29(25-12-6-3-7-13-25,28(31)23-9-4-2-5-10-23)17-19-30-18-15-24(21-30)26-14-8-11-22-16-20-32-27(22)26/h3,6-8,11-14,16,20,23-24H,2,4-5,9-10,15,17-19,21H2,1H3