N-(2-methylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide

Systemtic Name: N-(2-methylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-benzamide Openeye Name: 4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-N-(o-tolyl)benzamide CAS Name: N-(2-methylphenyl)-4-[(4-methyl-2-thiazolyl)thio]-3-nitrobenzamide IUPAC Name: N-(2-methylphenyl)-4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitrobenzamide Traditional Name: 4-[(4-methylthiazol-2-yl)thio]-3-nitro-N-(o-tolyl)benzamide Formula: C18H15N3O3S2 MolecularWeight: 385.46

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC3=NC(=CS3)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1NC(=O)C2=CC(=C(C=C2)SC3=NC(=CS3)C)[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O3S2/c1-11-5-3-4-6-14(11)20-17(22)13-7-8-16(15(9-13)21(23)24)26-18-19-12(2)10-25-18/h3-10H,1-2H3,(H,20,22)