2-[1-[(4-methylsulfonylphenyl)methyl]-1,2,3-triazol-4-yl]ethanamine

Systemtic Name: 2-[1-[(4-methylsulfonylphenyl)methyl]-1,2,3-triazol-4-yl]ethanamine Openeye Name: 2-[1-[(4-methylsulfonylphenyl)methyl]triazol-4-yl]ethanamine CAS Name: 2-[1-[(4-methylsulfonylphenyl)methyl]-4-triazolyl]ethanamine IUPAC Name: 2-[1-[(4-methylsulfonylphenyl)methyl]triazol-4-yl]ethanamine Traditional Name: 2-[1-(4-mesylbenzyl)triazol-4-yl]ethylamine Formula: C12H16N4O2S MolecularWeight: 280.34604

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CN2C=C(N=N2)CCN

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CN2C=C(N=N2)CCN

InChI

InChI=1S/C12H16N4O2S/c1-19(17,18)12-4-2-10(3-5-12)8-16-9-11(6-7-13)14-15-16/h2-5,9H,6-8,13H2,1H3