2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: 2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-benzyl-2-[[5-(2,4-dichlorophenyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C17H14Cl2N4OS MolecularWeight: 393.29026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CSC2=NNC(=N2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CSC2=NNC(=N2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H14Cl2N4OS/c18-12-6-7-13(14(19)8-12)16-21-17(23-22-16)25-10-15(24)20-9-11-4-2-1-3-5-11/h1-8H,9-10H2,(H,20,24)(H,21,22,23)