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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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