4-methyl-N-[[2-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]carbamothioyl]benzamide

Systemtic Name: 4-methyl-N-[[2-(2-methylpropyl)-1,2,3,4-tetrazol-5-yl]carbamothioyl]benzamide Openeye Name: N-[(2-isobutyltetrazol-5-yl)carbamothioyl]-4-methyl-benzamide CAS Name: 4-methyl-N-[[[2-(2-methylpropyl)-5-tetrazolyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-methyl-N-[[2-(2-methylpropyl)tetrazol-5-yl]carbamothioyl]benzamide Traditional Name: N-[(2-isobutyltetrazol-5-yl)thiocarbamoyl]-4-methyl-benzamide Formula: C14H18N6OS MolecularWeight: 318.39732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)CC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)CC(C)C

InChI

InChI=1S/C14H18N6OS/c1-9(2)8-20-18-13(17-19-20)16-14(22)15-12(21)11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3,(H2,15,16,18,21,22)