4-[4-[[2-(2-methylcyclohexyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenyl]-1-piperidin-1-yl-butan-1-one

Systemtic Name: 4-[4-[[2-(2-methylcyclohexyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenyl]-1-piperidin-1-yl-butan-1-one Openeye Name: 4-[4-[6-hydroxy-2-(2-methylcyclohexyl)benzothiophene-3-carbonyl]phenyl]-1-(1-piperidyl)butan-1-one CAS Name: 4-[4-[[6-hydroxy-2-(2-methylcyclohexyl)-1-benzothiophen-3-yl]-oxomethyl]phenyl]-1-(1-piperidinyl)-1-butanone IUPAC Name: 4-[4-[6-hydroxy-2-(2-methylcyclohexyl)-1-benzothiophene-3-carbonyl]phenyl]-1-piperidin-1-ylbutan-1-one Traditional Name: 4-[4-[6-hydroxy-2-(2-methylcyclohexyl)benzothiophene-3-carbonyl]phenyl]-1-piperidino-butan-1-one Formula: C31H37NO3S MolecularWeight: 503.69538

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCCC(=O)N5CCCCC5

Isomeric SMILES

CC1CCCCC1C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCCC(=O)N5CCCCC5

InChI

InChI=1S/C31H37NO3S/c1-21-8-3-4-10-25(21)31-29(26-17-16-24(33)20-27(26)36-31)30(35)23-14-12-22(13-15-23)9-7-11-28(34)32-18-5-2-6-19-32/h12-17,20-21,25,33H,2-11,18-19H2,1H3