N-[(4-chlorophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine Openeye Name: N-[(4-chlorophenyl)methyl]-2-ethylsulfonyl-5-(p-tolyl)-1,2,4-triazol-3-amine CAS Name: N-[(4-chlorophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine IUPAC Name: N-[(4-chlorophenyl)methyl]-2-ethylsulfonyl-5-(4-methylphenyl)-1,2,4-triazol-3-amine Traditional Name: (4-chlorobenzyl)-[2-esyl-5-(p-tolyl)-1,2,4-triazol-3-yl]amine Formula: C18H19ClN4O2S MolecularWeight: 390.88706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)C)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=C(C=C2)C)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H19ClN4O2S/c1-3-26(24,25)23-18(20-12-14-6-10-16(19)11-7-14)21-17(22-23)15-8-4-13(2)5-9-15/h4-11H,3,12H2,1-2H3,(H,20,21,22)