3-chloranyl-N-[2-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]ethyl]benzamide

Systemtic Name: 3-chloranyl-N-[2-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]ethyl]benzamide Openeye Name: 3-chloro-N-[2-(5-isobutylsulfanyl-4-methyl-1,2,4-triazol-3-yl)ethyl]benzamide CAS Name: 3-chloro-N-[2-[4-methyl-5-(2-methylpropylthio)-1,2,4-triazol-3-yl]ethyl]benzamide IUPAC Name: 3-chloro-N-[2-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]ethyl]benzamide Traditional Name: 3-chloro-N-[2-[5-(isobutylthio)-4-methyl-1,2,4-triazol-3-yl]ethyl]benzamide Formula: C16H21ClN4OS MolecularWeight: 352.88214

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C)CCNC(=O)C2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CSC1=NN=C(N1C)CCNC(=O)C2=CC(=CC=C2)Cl

InChI

InChI=1S/C16H21ClN4OS/c1-11(2)10-23-16-20-19-14(21(16)3)7-8-18-15(22)12-5-4-6-13(17)9-12/h4-6,9,11H,7-8,10H2,1-3H3,(H,18,22)