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

Systemtic Name: 2-iodanyl-N-[(2-propyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 2-iodo-N-[(2-propyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 2-iodo-N-[[(2-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-iodo-N-[(2-propyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 2-iodo-N-[(2-propyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C12H13IN6OS MolecularWeight: 416.24069

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1N=C(N=N1)NC(=S)NC(=O)C2=CC=CC=C2I

Isomeric SMILES

CCCN1N=C(N=N1)NC(=S)NC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C12H13IN6OS/c1-2-7-19-17-11(16-18-19)15-12(21)14-10(20)8-5-3-4-6-9(8)13/h3-6H,2,7H2,1H3,(H2,14,15,17,20,21)