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

Systemtic Name: N-[(2-butyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: N-[(2-butyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: N-[[(2-butyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[(2-butyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: N-[(2-butyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C13H16N6OS MolecularWeight: 304.37074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)NC(=S)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCN1N=C(N=N1)NC(=S)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C13H16N6OS/c1-2-3-9-19-17-12(16-18-19)15-13(21)14-11(20)10-7-5-4-6-8-10/h4-8H,2-3,9H2,1H3,(H2,14,15,17,20,21)