3-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one

Systemtic Name: 3-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Openeye Name: 3-[[(2R)-4-isobutylmorpholin-2-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one CAS Name: 3-[[(2R)-4-(2-methylpropyl)-2-morpholinyl]methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one IUPAC Name: 3-[[(2R)-4-(2-methylpropyl)morpholin-2-yl]methylsulfanyl]-4-phenethyl-1H-1,2,4-triazol-5-one Traditional Name: 3-[[(2R)-4-isobutylmorpholin-2-yl]methylthio]-4-phenethyl-1H-1,2,4-triazol-5-one Formula: C19H28N4O2S MolecularWeight: 376.51622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCOC(C1)CSC2=NNC(=O)N2CCC3=CC=CC=C3

Isomeric SMILES

CC(C)CN1CCO[C@H](C1)CSC2=NNC(=O)N2CCC3=CC=CC=C3

InChI

InChI=1S/C19H28N4O2S/c1-15(2)12-22-10-11-25-17(13-22)14-26-19-21-20-18(24)23(19)9-8-16-6-4-3-5-7-16/h3-7,15,17H,8-14H2,1-2H3,(H,20,24)/t17-/m1/s1