7-bromanyl-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfanyl-decanenitrile

Systemtic Name: 7-bromanyl-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfanyl-decanenitrile Openeye Name: 7-bromo-2-(3,4-dimethoxyphenyl)-2-(p-tolylsulfanyl)decanenitrile CAS Name: 7-bromo-2-(3,4-dimethoxyphenyl)-2-[(4-methylphenyl)thio]decanenitrile IUPAC Name: 7-bromo-2-(3,4-dimethoxyphenyl)-2-(4-methylphenyl)sulfanyldecanenitrile Traditional Name: 7-bromo-2-(3,4-dimethoxyphenyl)-2-(p-tolylthio)capronitrile Formula: C25H32BrNO2S MolecularWeight: 490.49608

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCCCC(C#N)(C1=CC(=C(C=C1)OC)OC)SC2=CC=C(C=C2)C)Br

Isomeric SMILES

CCCC(CCCCC(C#N)(C1=CC(=C(C=C1)OC)OC)SC2=CC=C(C=C2)C)Br

InChI

InChI=1S/C25H32BrNO2S/c1-5-8-21(26)9-6-7-16-25(18-27,30-22-13-10-19(2)11-14-22)20-12-15-23(28-3)24(17-20)29-4/h10-15,17,21H,5-9,16H2,1-4H3