(1S)-1-[4-(2-methylpropyl)-5-prop-2-enylsulfonyl-1,2,4-triazol-3-yl]-2-phenyl-ethanamine

Systemtic Name: (1S)-1-[4-(2-methylpropyl)-5-prop-2-enylsulfonyl-1,2,4-triazol-3-yl]-2-phenyl-ethanamine Openeye Name: (1S)-1-(5-allylsulfonyl-4-isobutyl-1,2,4-triazol-3-yl)-2-phenyl-ethanamine CAS Name: (1S)-1-[4-(2-methylpropyl)-5-prop-2-enylsulfonyl-1,2,4-triazol-3-yl]-2-phenylethanamine IUPAC Name: (1S)-1-[4-(2-methylpropyl)-5-prop-2-enylsulfonyl-1,2,4-triazol-3-yl]-2-phenylethanamine Traditional Name: [(1S)-1-(5-allylsulfonyl-4-isobutyl-1,2,4-triazol-3-yl)-2-phenyl-ethyl]amine Formula: C17H24N4O2S MolecularWeight: 348.46306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1S(=O)(=O)CC=C)C(CC2=CC=CC=C2)N

Isomeric SMILES

CC(C)CN1C(=NN=C1S(=O)(=O)CC=C)[C@H](CC2=CC=CC=C2)N

InChI

InChI=1S/C17H24N4O2S/c1-4-10-24(22,23)17-20-19-16(21(17)12-13(2)3)15(18)11-14-8-6-5-7-9-14/h4-9,13,15H,1,10-12,18H2,2-3H3/t15-/m0/s1