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

Systemtic Name: 3-[4-[(2-cyclohexyl-6-oxidanyl-1-benzothiophen-3-yl)carbonyl]phenyl]-1-piperidin-1-yl-propan-1-one Openeye Name: 3-[4-(2-cyclohexyl-6-hydroxy-benzothiophene-3-carbonyl)phenyl]-1-(1-piperidyl)propan-1-one CAS Name: 3-[4-[(2-cyclohexyl-6-hydroxy-1-benzothiophen-3-yl)-oxomethyl]phenyl]-1-(1-piperidinyl)-1-propanone IUPAC Name: 3-[4-(2-cyclohexyl-6-hydroxy-1-benzothiophene-3-carbonyl)phenyl]-1-piperidin-1-ylpropan-1-one Traditional Name: 3-[4-(2-cyclohexyl-6-hydroxy-benzothiophene-3-carbonyl)phenyl]-1-piperidino-propan-1-one Formula: C29H33NO3S MolecularWeight: 475.64222

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCC(=O)N5CCCCC5

Isomeric SMILES

C1CCC(CC1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)CCC(=O)N5CCCCC5

InChI

InChI=1S/C29H33NO3S/c31-23-14-15-24-25(19-23)34-29(22-7-3-1-4-8-22)27(24)28(33)21-12-9-20(10-13-21)11-16-26(32)30-17-5-2-6-18-30/h9-10,12-15,19,22,31H,1-8,11,16-18H2