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

Systemtic Name: N-[(2-chlorophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Openeye Name: N-[(2-chlorophenyl)methyl]-2-methylsulfonyl-5-(p-tolyl)-1,2,4-triazol-3-amine CAS Name: N-[(2-chlorophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine IUPAC Name: N-[(2-chlorophenyl)methyl]-5-(4-methylphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Traditional Name: (2-chlorobenzyl)-[2-mesyl-5-(p-tolyl)-1,2,4-triazol-3-yl]amine Formula: C17H17ClN4O2S MolecularWeight: 376.86048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3Cl)S(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3Cl)S(=O)(=O)C

InChI

InChI=1S/C17H17ClN4O2S/c1-12-7-9-13(10-8-12)16-20-17(22(21-16)25(2,23)24)19-11-14-5-3-4-6-15(14)18/h3-10H,11H2,1-2H3,(H,19,20,21)