N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-nitro-benzamide

Systemtic Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-nitro-benzamide Openeye Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-nitro-benzamide CAS Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-nitrobenzamide IUPAC Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-nitrobenzamide Traditional Name: N-(5-cyclopropyl-1,3,4-thiadiazol-2-yl)-3-methyl-4-nitro-benzamide Formula: C13H12N4O3S MolecularWeight: 304.32438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)C3CC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=NN=C(S2)C3CC3)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O3S/c1-7-6-9(4-5-10(7)17(19)20)11(18)14-13-16-15-12(21-13)8-2-3-8/h4-6,8H,2-3H2,1H3,(H,14,16,18)