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

Systemtic Name: N-butan-2-yl-2-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide Openeye Name: 2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanyl-N-sec-butyl-acetamide CAS Name: N-butan-2-yl-2-[[1-(4-chlorophenyl)-5-tetrazolyl]thio]acetamide IUPAC Name: N-butan-2-yl-2-[1-(4-chlorophenyl)tetrazol-5-yl]sulfanylacetamide Traditional Name: 2-[[1-(4-chlorophenyl)tetrazol-5-yl]thio]-N-sec-butyl-acetamide Formula: C13H16ClN5OS MolecularWeight: 325.81704

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NN=NN1C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC(C)NC(=O)CSC1=NN=NN1C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H16ClN5OS/c1-3-9(2)15-12(20)8-21-13-16-17-18-19(13)11-6-4-10(14)5-7-11/h4-7,9H,3,8H2,1-2H3,(H,15,20)