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

Systemtic Name: 3-(2-methylpropoxy)-N-[(1-propyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 3-isobutoxy-N-[(1-propyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 3-(2-methylpropoxy)-N-[[(1-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-(2-methylpropoxy)-N-[(1-propyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 3-isobutoxy-N-[(1-propyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C16H22N6O2S MolecularWeight: 362.44988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

Isomeric SMILES

CCCN1C(=NN=N1)NC(=S)NC(=O)C2=CC(=CC=C2)OCC(C)C

InChI

InChI=1S/C16H22N6O2S/c1-4-8-22-15(19-20-21-22)18-16(25)17-14(23)12-6-5-7-13(9-12)24-10-11(2)3/h5-7,9,11H,4,8,10H2,1-3H3,(H2,17,18,19,21,23,25)