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

Systemtic Name: 4-butoxy-N-[(2-methyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[(2-methyl-5-tetrazolyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(2-methyltetrazol-5-yl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(2-methyltetrazol-5-yl)thiocarbamoyl]benzamide Formula: C14H18N6O2S MolecularWeight: 334.39672

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NN(N=N2)C

InChI

InChI=1S/C14H18N6O2S/c1-3-4-9-22-11-7-5-10(6-8-11)12(21)15-14(23)16-13-17-19-20(2)18-13/h5-8H,3-4,9H2,1-2H3,(H2,15,16,18,21,23)