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

Systemtic Name: N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[(2-methyltetrazol-5-yl)carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[(2-methyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(2-methyltetrazol-5-yl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(2-methyltetrazol-5-yl)thiocarbamoyl]-3-propoxy-benzamide Formula: C13H16N6O2S MolecularWeight: 320.37014

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NN(N=N2)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NN(N=N2)C

InChI

InChI=1S/C13H16N6O2S/c1-3-7-21-10-6-4-5-9(8-10)11(20)14-13(22)15-12-16-18-19(2)17-12/h4-6,8H,3,7H2,1-2H3,(H2,14,15,17,20,22)