2-chloranyl-N-(2,6-diethylphenyl)-N-[(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-4-ium-5-yl)methyl]ethanamide

Systemtic Name: 2-chloranyl-N-(2,6-diethylphenyl)-N-[(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-4-ium-5-yl)methyl]ethanamide Openeye Name: 2-chloro-N-(2,6-diethylphenyl)-N-[(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-4-ium-5-yl)methyl]acetamide CAS Name: 2-chloro-N-(2,6-diethylphenyl)-N-[[4-methyl-3-(methylthio)-1H-1,2,4-triazol-4-ium-5-yl]methyl]acetamide IUPAC Name: 2-chloro-N-(2,6-diethylphenyl)-N-[(4-methyl-3-methylsulfanyl-1H-1,2,4-triazol-4-ium-5-yl)methyl]acetamide Traditional Name: 2-chloro-N-(2,6-diethylphenyl)-N-[[4-methyl-3-(methylthio)-1H-1,2,4-triazol-4-ium-5-yl]methyl]acetamide Formula: C17H24ClN4OS+ MolecularWeight: 367.91666

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N(CC2=[N+](C(=NN2)SC)C)C(=O)CCl

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N(CC2=[N+](C(=NN2)SC)C)C(=O)CCl

InChI

InChI=1S/C17H23ClN4OS/c1-5-12-8-7-9-13(6-2)16(12)22(15(23)10-18)11-14-19-20-17(24-4)21(14)3/h7-9H,5-6,10-11H2,1-4H3/p+1