[4-(2-dimethylaminoethyloxy)phenyl]-[6-methoxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]methanone

Systemtic Name: [4-(2-dimethylaminoethyloxy)phenyl]-[6-methoxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]methanone Openeye Name: [4-(2-dimethylaminoethyloxy)phenyl]-[6-methoxy-2-(3-methylcyclohexyl)benzothiophen-3-yl]methanone CAS Name: [4-(2-dimethylaminoethyloxy)phenyl]-[6-methoxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]methanone IUPAC Name: [4-(2-dimethylaminoethyloxy)phenyl]-[6-methoxy-2-(3-methylcyclohexyl)-1-benzothiophen-3-yl]methanone Traditional Name: [4-(2-dimethylaminoethyloxy)phenyl]-[6-methoxy-2-(3-methylcyclohexyl)benzothiophen-3-yl]methanone Formula: C27H33NO3S MolecularWeight: 451.62082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33NO3S/c1-18-6-5-7-20(16-18)27-25(23-13-12-22(30-4)17-24(23)32-27)26(29)19-8-10-21(11-9-19)31-15-14-28(2)3/h8-13,17-18,20H,5-7,14-16H2,1-4H3