2-(3,4-dimethylphenyl)sulfanyl-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide

Systemtic Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[2-[(4-nitrophenyl)amino]ethyl]ethanamide Openeye Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[2-(4-nitroanilino)ethyl]acetamide CAS Name: 2-[(3,4-dimethylphenyl)thio]-N-[2-(4-nitroanilino)ethyl]acetamide IUPAC Name: 2-(3,4-dimethylphenyl)sulfanyl-N-[2-(4-nitroanilino)ethyl]acetamide Traditional Name: 2-[(3,4-dimethylphenyl)thio]-N-[2-(4-nitroanilino)ethyl]acetamide Formula: C18H21N3O3S MolecularWeight: 359.44264

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(C=C(C=C1)SCC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H21N3O3S/c1-13-3-8-17(11-14(13)2)25-12-18(22)20-10-9-19-15-4-6-16(7-5-15)21(23)24/h3-8,11,19H,9-10,12H2,1-2H3,(H,20,22)