4-(methylamino)-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-3-nitro-benzamide

Systemtic Name: 4-(methylamino)-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-3-nitro-benzamide Openeye Name: 4-(methylamino)-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-3-nitro-benzamide CAS Name: 4-(methylamino)-N-[4-methyl-5-(1-methyl-2-imidazolyl)-2-thiazolyl]-3-nitrobenzamide IUPAC Name: 4-(methylamino)-N-[4-methyl-5-(1-methylimidazol-2-yl)-1,3-thiazol-2-yl]-3-nitrobenzamide Traditional Name: 4-(methylamino)-N-[4-methyl-5-(1-methylimidazol-2-yl)thiazol-2-yl]-3-nitro-benzamide Formula: C16H16N6O3S MolecularWeight: 372.40164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-])C3=NC=CN3C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC(=C(C=C2)NC)[N+](=O)[O-])C3=NC=CN3C

InChI

InChI=1S/C16H16N6O3S/c1-9-13(14-18-6-7-21(14)3)26-16(19-9)20-15(23)10-4-5-11(17-2)12(8-10)22(24)25/h4-8,17H,1-3H3,(H,19,20,23)