N-(2-ethyl-6-methyl-phenyl)-2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(2-ethyl-6-methyl-phenyl)-2-[(1-naphthalen-1-yl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(2-ethyl-6-methyl-phenyl)-2-[1-(1-naphthyl)tetrazol-5-yl]sulfanyl-acetamide CAS Name: N-(2-ethyl-6-methylphenyl)-2-[[1-(1-naphthalenyl)-5-tetrazolyl]thio]acetamide IUPAC Name: N-(2-ethyl-6-methylphenyl)-2-(1-naphthalen-1-yltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(2-ethyl-6-methyl-phenyl)-2-[[1-(1-naphthyl)tetrazol-5-yl]thio]acetamide Formula: C22H21N5OS MolecularWeight: 403.50004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)CSC2=NN=NN2C3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)CSC2=NN=NN2C3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C22H21N5OS/c1-3-16-10-6-8-15(2)21(16)23-20(28)14-29-22-24-25-26-27(22)19-13-7-11-17-9-4-5-12-18(17)19/h4-13H,3,14H2,1-2H3,(H,23,28)