2-(2,4-dimethylphenyl)sulfanyl-N-(3-nitrophenyl)propanamide

Systemtic Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(3-nitrophenyl)propanamide Openeye Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(3-nitrophenyl)propanamide CAS Name: 2-[(2,4-dimethylphenyl)thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-(2,4-dimethylphenyl)sulfanyl-N-(3-nitrophenyl)propanamide Traditional Name: 2-[(2,4-dimethylphenyl)thio]-N-(3-nitrophenyl)propionamide Formula: C17H18N2O3S MolecularWeight: 330.40142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)SC(C)C(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C

InChI

InChI=1S/C17H18N2O3S/c1-11-7-8-16(12(2)9-11)23-13(3)17(20)18-14-5-4-6-15(10-14)19(21)22/h4-10,13H,1-3H3,(H,18,20)