3-methyl-N-[(6-methylpyridin-2-yl)carbamothioyl]-4-nitro-benzamide

Systemtic Name: 3-methyl-N-[(6-methylpyridin-2-yl)carbamothioyl]-4-nitro-benzamide Openeye Name: 3-methyl-N-[(6-methyl-2-pyridyl)carbamothioyl]-4-nitro-benzamide CAS Name: 3-methyl-N-[[(6-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]-4-nitrobenzamide IUPAC Name: 3-methyl-N-[(6-methylpyridin-2-yl)carbamothioyl]-4-nitrobenzamide Traditional Name: 3-methyl-N-[(6-methyl-2-pyridyl)thiocarbamoyl]-4-nitro-benzamide Formula: C15H14N4O3S MolecularWeight: 330.36166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H14N4O3S/c1-9-8-11(6-7-12(9)19(21)22)14(20)18-15(23)17-13-5-3-4-10(2)16-13/h3-8H,1-2H3,(H2,16,17,18,20,23)