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

Systemtic Name: N-[(2-butyl-1,2,3,4-tetrazol-5-yl)carbamothioyl]-2-(4-chlorophenyl)ethanamide Openeye Name: N-[(2-butyltetrazol-5-yl)carbamothioyl]-2-(4-chlorophenyl)acetamide CAS Name: N-[[(2-butyl-5-tetrazolyl)amino]-sulfanylidenemethyl]-2-(4-chlorophenyl)acetamide IUPAC Name: N-[(2-butyltetrazol-5-yl)carbamothioyl]-2-(4-chlorophenyl)acetamide Traditional Name: N-[(2-butyltetrazol-5-yl)thiocarbamoyl]-2-(4-chlorophenyl)acetamide Formula: C14H17ClN6OS MolecularWeight: 352.84238

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1N=C(N=N1)NC(=S)NC(=O)CC2=CC=C(C=C2)Cl

Isomeric SMILES

CCCCN1N=C(N=N1)NC(=S)NC(=O)CC2=CC=C(C=C2)Cl

InChI

InChI=1S/C14H17ClN6OS/c1-2-3-8-21-19-13(18-20-21)17-14(23)16-12(22)9-10-4-6-11(15)7-5-10/h4-7H,2-3,8-9H2,1H3,(H2,16,17,19,22,23)