4-[2-(2-azanyl-4-methyl-phenyl)sulfanylethoxy]benzenecarbonitrile

Systemtic Name: 4-[2-(2-azanyl-4-methyl-phenyl)sulfanylethoxy]benzenecarbonitrile Openeye Name: 4-[2-(2-amino-4-methyl-phenyl)sulfanylethoxy]benzonitrile CAS Name: 4-[2-[(2-amino-4-methylphenyl)thio]ethoxy]benzonitrile IUPAC Name: 4-[2-(2-amino-4-methylphenyl)sulfanylethoxy]benzonitrile Traditional Name: 4-[2-[(2-amino-4-methyl-phenyl)thio]ethoxy]benzonitrile Formula: C16H16N2OS MolecularWeight: 284.37604

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCCOC2=CC=C(C=C2)C#N)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCCOC2=CC=C(C=C2)C#N)N

InChI

InChI=1S/C16H16N2OS/c1-12-2-7-16(15(18)10-12)20-9-8-19-14-5-3-13(11-17)4-6-14/h2-7,10H,8-9,18H2,1H3