N-octyl-3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzamide

Systemtic Name: N-octyl-3-(5-sulfanylidene-2H-1,2,3,4-tetrazol-1-yl)benzamide Openeye Name: N-octyl-3-(5-thioxo-2H-tetrazol-1-yl)benzamide CAS Name: N-octyl-3-(5-sulfanylidene-2H-tetrazol-1-yl)benzamide IUPAC Name: N-octyl-3-(5-sulfanylidene-2H-tetrazol-1-yl)benzamide Traditional Name: N-octyl-3-(5-thioxo-2H-tetrazol-1-yl)benzamide Formula: C16H23N5OS MolecularWeight: 333.45172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C1=CC(=CC=C1)N2C(=S)N=NN2

Isomeric SMILES

CCCCCCCCNC(=O)C1=CC(=CC=C1)N2C(=S)N=NN2

InChI

InChI=1S/C16H23N5OS/c1-2-3-4-5-6-7-11-17-15(22)13-9-8-10-14(12-13)21-16(23)18-19-20-21/h8-10,12H,2-7,11H2,1H3,(H,17,22)(H,18,20,23)