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

Systemtic Name: N-[3-(tert-butylamino)propyl]-2-[[1-(3-chlorophenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]ethanamide Openeye Name: N-[3-(tert-butylamino)propyl]-2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanyl-acetamide CAS Name: N-[3-(tert-butylamino)propyl]-2-[[1-(3-chlorophenyl)-5-tetrazolyl]thio]acetamide IUPAC Name: N-[3-(tert-butylamino)propyl]-2-[1-(3-chlorophenyl)tetrazol-5-yl]sulfanylacetamide Traditional Name: N-[3-(tert-butylamino)propyl]-2-[[1-(3-chlorophenyl)tetrazol-5-yl]thio]acetamide Formula: C16H23ClN6OS MolecularWeight: 382.91142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCCCNC(=O)CSC1=NN=NN1C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)(C)NCCCNC(=O)CSC1=NN=NN1C2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H23ClN6OS/c1-16(2,3)19-9-5-8-18-14(24)11-25-15-20-21-22-23(15)13-7-4-6-12(17)10-13/h4,6-7,10,19H,5,8-9,11H2,1-3H3,(H,18,24)