4-(3,4-dimethoxyphenyl)-8a-methylsulfanyl-2-phenyl-4,4a,5,6,7,8-hexahydrothiochromene

Systemtic Name: 4-(3,4-dimethoxyphenyl)-8a-methylsulfanyl-2-phenyl-4,4a,5,6,7,8-hexahydrothiochromene Openeye Name: 4-(3,4-dimethoxyphenyl)-8a-methylsulfanyl-2-phenyl-4,4a,5,6,7,8-hexahydrothiochromene CAS Name: 4-(3,4-dimethoxyphenyl)-8a-(methylthio)-2-phenyl-4,4a,5,6,7,8-hexahydro-1-benzothiopyran IUPAC Name: 4-(3,4-dimethoxyphenyl)-8a-methylsulfanyl-2-phenyl-4,4a,5,6,7,8-hexahydrothiochromene Traditional Name: 4-(3,4-dimethoxyphenyl)-8a-(methylthio)-2-phenyl-4,4a,5,6,7,8-hexahydrothiochromene Formula: C24H28O2S2 MolecularWeight: 412.60792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2C=C(SC3(C2CCCC3)SC)C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2C=C(SC3(C2CCCC3)SC)C4=CC=CC=C4)OC

InChI

InChI=1S/C24H28O2S2/c1-25-21-13-12-18(15-22(21)26-2)19-16-23(17-9-5-4-6-10-17)28-24(27-3)14-8-7-11-20(19)24/h4-6,9-10,12-13,15-16,19-20H,7-8,11,14H2,1-3H3