N-(3-chloranyl-2,6-diethyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide

Systemtic Name: N-(3-chloranyl-2,6-diethyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanamide Openeye Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide CAS Name: N-(3-chloro-2,6-diethylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide IUPAC Name: N-(3-chloro-2,6-diethylphenyl)-2-(1H-1,2,4-triazol-5-ylsulfanyl)acetamide Traditional Name: N-(3-chloro-2,6-diethyl-phenyl)-2-(1H-1,2,4-triazol-5-ylthio)acetamide Formula: C14H17ClN4OS MolecularWeight: 324.82898

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CSC2=NC=NN2

Isomeric SMILES

CCC1=C(C(=C(C=C1)Cl)CC)NC(=O)CSC2=NC=NN2

InChI

InChI=1S/C14H17ClN4OS/c1-3-9-5-6-11(15)10(4-2)13(9)18-12(20)7-21-14-16-8-17-19-14/h5-6,8H,3-4,7H2,1-2H3,(H,18,20)(H,16,17,19)