5-(4-methoxyphenyl)-2-methylsulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine

Systemtic Name: 5-(4-methoxyphenyl)-2-methylsulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine Openeye Name: N-benzyl-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine CAS Name: 5-(4-methoxyphenyl)-2-methylsulfonyl-N-(phenylmethyl)-1,2,4-triazol-3-amine IUPAC Name: N-benzyl-5-(4-methoxyphenyl)-2-methylsulfonyl-1,2,4-triazol-3-amine Traditional Name: benzyl-[2-mesyl-5-(4-methoxyphenyl)-1,2,4-triazol-3-yl]amine Formula: C17H18N4O3S MolecularWeight: 358.41482

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4O3S/c1-24-15-10-8-14(9-11-15)16-19-17(21(20-16)25(2,22)23)18-12-13-6-4-3-5-7-13/h3-11H,12H2,1-2H3,(H,18,19,20)