2-[2-(3,4-dimethoxyphenyl)cyclohexyl]-3-phenyl-benzenecarbothioamide

Systemtic Name: 2-[2-(3,4-dimethoxyphenyl)cyclohexyl]-3-phenyl-benzenecarbothioamide Openeye Name: 2-[2-(3,4-dimethoxyphenyl)cyclohexyl]-3-phenyl-benzenecarbothioamide CAS Name: 2-[2-(3,4-dimethoxyphenyl)cyclohexyl]-3-phenylbenzenecarbothioamide IUPAC Name: 2-[2-(3,4-dimethoxyphenyl)cyclohexyl]-3-phenylbenzenecarbothioamide Traditional Name: 2-[2-(3,4-dimethoxyphenyl)cyclohexyl]-3-phenyl-thiobenzamide Formula: C27H29NO2S MolecularWeight: 431.58966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCCC2C3=C(C=CC=C3C(=S)N)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCCC2C3=C(C=CC=C3C(=S)N)C4=CC=CC=C4)OC

InChI

InChI=1S/C27H29NO2S/c1-29-24-16-15-19(17-25(24)30-2)20-11-6-7-12-22(20)26-21(18-9-4-3-5-10-18)13-8-14-23(26)27(28)31/h3-5,8-10,13-17,20,22H,6-7,11-12H2,1-2H3,(H2,28,31)