3-(4-tert-butylphenyl)sulfanyl-5-(4-methoxyoxan-4-yl)benzenecarbonitrile

Systemtic Name: 3-(4-tert-butylphenyl)sulfanyl-5-(4-methoxyoxan-4-yl)benzenecarbonitrile Openeye Name: 3-(4-tert-butylphenyl)sulfanyl-5-(4-methoxytetrahydropyran-4-yl)benzonitrile CAS Name: 3-[(4-tert-butylphenyl)thio]-5-(4-methoxy-4-oxanyl)benzonitrile IUPAC Name: 3-(4-tert-butylphenyl)sulfanyl-5-(4-methoxyoxan-4-yl)benzonitrile Traditional Name: 3-[(4-tert-butylphenyl)thio]-5-(4-methoxytetrahydropyran-4-yl)benzonitrile Formula: C23H27NO2S MolecularWeight: 381.53098

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SC2=CC(=CC(=C2)C3(CCOCC3)OC)C#N

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SC2=CC(=CC(=C2)C3(CCOCC3)OC)C#N

InChI

InChI=1S/C23H27NO2S/c1-22(2,3)18-5-7-20(8-6-18)27-21-14-17(16-24)13-19(15-21)23(25-4)9-11-26-12-10-23/h5-8,13-15H,9-12H2,1-4H3