3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one

Systemtic Name: 3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one Openeye Name: 3-[(3S,5S)-3,5-dimethyl-1-piperidyl]-6-phenyl-2H-1,2,4-triazin-5-one CAS Name: 3-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-6-phenyl-2H-1,2,4-triazin-5-one IUPAC Name: 3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-6-phenyl-2H-1,2,4-triazin-5-one Traditional Name: 3-[(3S,5S)-3,5-dimethylpiperidino]-6-phenyl-2H-1,2,4-triazin-5-one Formula: C16H20N4O MolecularWeight: 284.3562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC(=O)C(=NN2)C3=CC=CC=C3)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C2=NC(=O)C(=NN2)C3=CC=CC=C3)C

InChI

InChI=1S/C16H20N4O/c1-11-8-12(2)10-20(9-11)16-17-15(21)14(18-19-16)13-6-4-3-5-7-13/h3-7,11-12H,8-10H2,1-2H3,(H,17,19,21)/t11-,12-/m0/s1