(1S)-1-(4-ethyl-5-methylsulfonyl-1,2,4-triazol-3-yl)-2-phenyl-ethanamine

Systemtic Name: (1S)-1-(4-ethyl-5-methylsulfonyl-1,2,4-triazol-3-yl)-2-phenyl-ethanamine Openeye Name: (1S)-1-(4-ethyl-5-methylsulfonyl-1,2,4-triazol-3-yl)-2-phenyl-ethanamine CAS Name: (1S)-1-(4-ethyl-5-methylsulfonyl-1,2,4-triazol-3-yl)-2-phenylethanamine IUPAC Name: (1S)-1-(4-ethyl-5-methylsulfonyl-1,2,4-triazol-3-yl)-2-phenylethanamine Traditional Name: [(1S)-1-(4-ethyl-5-mesyl-1,2,4-triazol-3-yl)-2-phenyl-ethyl]amine Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1S(=O)(=O)C)C(CC2=CC=CC=C2)N

Isomeric SMILES

CCN1C(=NN=C1S(=O)(=O)C)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C13H18N4O2S/c1-3-17-12(15-16-13(17)20(2,18)19)11(14)9-10-7-5-4-6-8-10/h4-8,11H,3,9,14H2,1-2H3/t11-/m0/s1