[2-(3-methylcyclohexyl)-6-oxidanyl-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone

Systemtic Name: [2-(3-methylcyclohexyl)-6-oxidanyl-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone Openeye Name: [6-hydroxy-2-(3-methylcyclohexyl)benzothiophen-3-yl]-[4-[2-(1-piperidyl)ethoxy]phenyl]methanone CAS Name: [6-hydroxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]-[4-[2-(1-piperidinyl)ethoxy]phenyl]methanone IUPAC Name: [6-hydroxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]-[4-(2-piperidin-1-ylethoxy)phenyl]methanone Traditional Name: [6-hydroxy-2-(3-methylcyclohexyl)benzothiophen-3-yl]-[4-(2-piperidinoethoxy)phenyl]methanone Formula: C29H35NO3S MolecularWeight: 477.6581

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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)OCCN5CCCCC5

Isomeric SMILES

CC1CCCC(C1)C2=C(C3=C(S2)C=C(C=C3)O)C(=O)C4=CC=C(C=C4)OCCN5CCCCC5

InChI

InChI=1S/C29H35NO3S/c1-20-6-5-7-22(18-20)29-27(25-13-10-23(31)19-26(25)34-29)28(32)21-8-11-24(12-9-21)33-17-16-30-14-3-2-4-15-30/h8-13,19-20,22,31H,2-7,14-18H2,1H3