4-methyl-3-nitro-N-(2-nitrophenyl)sulfanyl-aniline

Systemtic Name: 4-methyl-3-nitro-N-(2-nitrophenyl)sulfanyl-aniline Openeye Name: 4-methyl-3-nitro-N-(2-nitrophenyl)sulfanyl-aniline CAS Name: N-(4-methyl-3-nitrophenyl)-2-nitrobenzenesulfenamide IUPAC Name: 4-methyl-3-nitro-N-(2-nitrophenyl)sulfanylaniline Traditional Name: (4-methyl-3-nitro-phenyl)-[(2-nitrophenyl)thio]amine Formula: C13H11N3O4S MolecularWeight: 305.30914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NSC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NSC2=CC=CC=C2[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H11N3O4S/c1-9-6-7-10(8-12(9)16(19)20)14-21-13-5-3-2-4-11(13)15(17)18/h2-8,14H,1H3