4-methyl-N-(3-methylsulfanylphenyl)-3-nitro-benzamide

Systemtic Name: 4-methyl-N-(3-methylsulfanylphenyl)-3-nitro-benzamide Openeye Name: 4-methyl-N-(3-methylsulfanylphenyl)-3-nitro-benzamide CAS Name: 4-methyl-N-[3-(methylthio)phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-(3-methylsulfanylphenyl)-3-nitrobenzamide Traditional Name: 4-methyl-N-[3-(methylthio)phenyl]-3-nitro-benzamide Formula: C15H14N2O3S MolecularWeight: 302.34826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N2O3S/c1-10-6-7-11(8-14(10)17(19)20)15(18)16-12-4-3-5-13(9-12)21-2/h3-9H,1-2H3,(H,16,18)