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

Systemtic Name: N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Openeye Name: N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine CAS Name: N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine IUPAC Name: N-[(2-chlorophenyl)methyl]-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Traditional Name: (2-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=CC=C3Cl)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=N2)NCC3=CC=CC=C3Cl)S(=O)(=O)C

InChI

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