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

Systemtic Name: 3-butoxy-N-[(1-propyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(1-propyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[(1-propyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(1-propyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(1-propyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C16H22N6O2S MolecularWeight: 362.44988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NN=NN2CCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=NN=NN2CCC

InChI

InChI=1S/C16H22N6O2S/c1-3-5-10-24-13-8-6-7-12(11-13)14(23)17-16(25)18-15-19-20-21-22(15)9-4-2/h6-8,11H,3-5,9-10H2,1-2H3,(H2,17,18,19,21,23,25)