3-(3,4-dimethylphenyl)sulfanyl-N-(3-methylsulfonylphenyl)propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(3-methylsulfonylphenyl)propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(3-methylsulfonylphenyl)propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-(3-methylsulfonylphenyl)propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-(3-methylsulfonylphenyl)propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-(3-mesylphenyl)propionamide Formula: C18H21NO3S2 MolecularWeight: 363.49424

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)SCCC(=O)NC2=CC(=CC=C2)S(=O)(=O)C)C

InChI

InChI=1S/C18H21NO3S2/c1-13-7-8-16(11-14(13)2)23-10-9-18(20)19-15-5-4-6-17(12-15)24(3,21)22/h4-8,11-12H,9-10H2,1-3H3,(H,19,20)