2-[5-ethylsulfonyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine

Systemtic Name: 2-[5-ethylsulfonyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine Openeye Name: 2-(4-benzyl-5-ethylsulfonyl-1,2,4-triazol-3-yl)ethanamine CAS Name: 2-[5-ethylsulfonyl-4-(phenylmethyl)-1,2,4-triazol-3-yl]ethanamine IUPAC Name: 2-(4-benzyl-5-ethylsulfonyl-1,2,4-triazol-3-yl)ethanamine Traditional Name: 2-(4-benzyl-5-esyl-1,2,4-triazol-3-yl)ethylamine Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=NN=C(N1CC2=CC=CC=C2)CCN

Isomeric SMILES

CCS(=O)(=O)C1=NN=C(N1CC2=CC=CC=C2)CCN

InChI

InChI=1S/C13H18N4O2S/c1-2-20(18,19)13-16-15-12(8-9-14)17(13)10-11-6-4-3-5-7-11/h3-7H,2,8-10,14H2,1H3