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

Systemtic Name: 3-[4-[[2-(3-methylcyclohexyl)-6-oxidanyl-1-benzothiophen-3-yl]carbonyl]phenyl]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[4-[6-hydroxy-2-(3-methylcyclohexyl)benzothiophene-3-carbonyl]phenyl]-1-(1-piperidyl)propan-1-one CAS Name: 3-[4-[[6-hydroxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]-oxomethyl]phenyl]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[4-[6-hydroxy-2-(3-methylcyclohexyl)-1-benzothiophene-3-carbonyl]phenyl]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[4-[6-hydroxy-2-(3-methylcyclohexyl)benzothiophene-3-carbonyl]phenyl]-1-piperidino-propan-1-one Formula: C30H35NO3S MolecularWeight: 489.6688

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCC(=O)N5CCCCC5

Isomeric SMILES

CC1CCCC(C1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCC(=O)N5CCCCC5

InChI

InChI=1S/C30H35NO3S/c1-20-6-5-7-23(18-20)30-28(25-14-13-24(32)19-26(25)35-30)29(34)22-11-8-21(9-12-22)10-15-27(33)31-16-3-2-4-17-31/h8-9,11-14,19-20,23,32H,2-7,10,15-18H2,1H3