N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-2-methyl-benzamide

Systemtic Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-2-methyl-benzamide Openeye Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-2-methyl-benzamide CAS Name: N-[3-[(4-chlorophenyl)methylthio]-1H-1,2,4-triazol-5-yl]-2-methylbenzamide IUPAC Name: N-[3-[(4-chlorophenyl)methylsulfanyl]-1H-1,2,4-triazol-5-yl]-2-methylbenzamide Traditional Name: N-[3-[(4-chlorobenzyl)thio]-1H-1,2,4-triazol-5-yl]-2-methyl-benzamide Formula: C17H15ClN4OS MolecularWeight: 358.8452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC2=NC(=NN2)SCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC2=NC(=NN2)SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H15ClN4OS/c1-11-4-2-3-5-14(11)15(23)19-16-20-17(22-21-16)24-10-12-6-8-13(18)9-7-12/h2-9H,10H2,1H3,(H2,19,20,21,22,23)