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

Systemtic Name: N-[(4-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Openeye Name: N-[(4-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine CAS Name: N-[(4-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine IUPAC Name: N-[(4-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Traditional Name: (4-chlorobenzyl)-[2-mesyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]amine Formula: C17H17ClN4O3S MolecularWeight: 392.85988

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=C(C=C3)Cl)S(=O)(=O)C

InChI

InChI=1S/C17H17ClN4O3S/c1-25-15-9-5-13(6-10-15)16-20-17(22(21-16)26(2,23)24)19-11-12-3-7-14(18)8-4-12/h3-10H,11H2,1-2H3,(H,19,20,21)