3-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-4,5-diphenyl-benzenecarbonitrile

Systemtic Name: 3-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-4,5-diphenyl-benzenecarbonitrile Openeye Name: 3-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-4,5-diphenyl-benzonitrile CAS Name: 3-(3,4-dimethoxyphenyl)-2-methyl-6-(methylthio)-4,5-diphenylbenzonitrile IUPAC Name: 3-(3,4-dimethoxyphenyl)-2-methyl-6-methylsulfanyl-4,5-diphenylbenzonitrile Traditional Name: 3-(3,4-dimethoxyphenyl)-2-methyl-6-(methylthio)-4,5-diphenyl-benzonitrile Formula: C29H25NO2S MolecularWeight: 451.5793

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C4=CC=CC=C4)SC)C#N

Isomeric SMILES

CC1=C(C(=C(C(=C1C2=CC(=C(C=C2)OC)OC)C3=CC=CC=C3)C4=CC=CC=C4)SC)C#N

InChI

InChI=1S/C29H25NO2S/c1-19-23(18-30)29(33-4)28(21-13-9-6-10-14-21)27(20-11-7-5-8-12-20)26(19)22-15-16-24(31-2)25(17-22)32-3/h5-17H,1-4H3