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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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