6-[(3S)-1-(3-methyl-4-morpholin-4-yl-phenyl)carbonylpiperidin-3-yl]-1H-pyrimidin-4-one

Systemtic Name: 6-[(3S)-1-(3-methyl-4-morpholin-4-yl-phenyl)carbonylpiperidin-3-yl]-1H-pyrimidin-4-one Openeye Name: 6-[(3S)-1-(3-methyl-4-morpholino-benzoyl)-3-piperidyl]-1H-pyrimidin-4-one CAS Name: 6-[(3S)-1-[[3-methyl-4-(4-morpholinyl)phenyl]-oxomethyl]-3-piperidinyl]-1H-pyrimidin-4-one IUPAC Name: 6-[(3S)-1-(3-methyl-4-morpholin-4-ylbenzoyl)piperidin-3-yl]-1H-pyrimidin-4-one Traditional Name: 6-[(3S)-1-(3-methyl-4-morpholino-benzoyl)-3-piperidyl]-1H-pyrimidin-4-one Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CCCC(C2)C3=CC(=O)N=CN3)N4CCOCC4

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CCC[C@@H](C2)C3=CC(=O)N=CN3)N4CCOCC4

InChI

InChI=1S/C21H26N4O3/c1-15-11-16(4-5-19(15)24-7-9-28-10-8-24)21(27)25-6-2-3-17(13-25)18-12-20(26)23-14-22-18/h4-5,11-12,14,17H,2-3,6-10,13H2,1H3,(H,22,23,26)/t17-/m0/s1