N-(2-cyanophenyl)-3-(2,5-dimethylphenyl)sulfanyl-propanamide

Systemtic Name: N-(2-cyanophenyl)-3-(2,5-dimethylphenyl)sulfanyl-propanamide Openeye Name: N-(2-cyanophenyl)-3-(2,5-dimethylphenyl)sulfanyl-propanamide CAS Name: N-(2-cyanophenyl)-3-[(2,5-dimethylphenyl)thio]propanamide IUPAC Name: N-(2-cyanophenyl)-3-(2,5-dimethylphenyl)sulfanylpropanamide Traditional Name: N-(2-cyanophenyl)-3-[(2,5-dimethylphenyl)thio]propionamide Formula: C18H18N2OS MolecularWeight: 310.41332

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCCC(=O)NC2=CC=CC=C2C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCCC(=O)NC2=CC=CC=C2C#N

InChI

InChI=1S/C18H18N2OS/c1-13-7-8-14(2)17(11-13)22-10-9-18(21)20-16-6-4-3-5-15(16)12-19/h3-8,11H,9-10H2,1-2H3,(H,20,21)