5-ethanoyl-6-methyl-4-[(2S)-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl]sulfanyl-1H-pyrimidin-2-one

Systemtic Name: 5-ethanoyl-6-methyl-4-[(2S)-1-oxidanylidene-1-[4-(phenylmethyl)piperidin-1-yl]propan-2-yl]sulfanyl-1H-pyrimidin-2-one Openeye Name: 5-acetyl-4-[(1S)-2-(4-benzyl-1-piperidyl)-1-methyl-2-oxo-ethyl]sulfanyl-6-methyl-1H-pyrimidin-2-one CAS Name: 5-acetyl-6-methyl-4-[[(2S)-1-oxo-1-[4-(phenylmethyl)-1-piperidinyl]propan-2-yl]thio]-1H-pyrimidin-2-one IUPAC Name: 5-acetyl-4-[(2S)-1-(4-benzylpiperidin-1-yl)-1-oxopropan-2-yl]sulfanyl-6-methyl-1H-pyrimidin-2-one Traditional Name: 5-acetyl-4-[[(1S)-2-(4-benzylpiperidino)-2-keto-1-methyl-ethyl]thio]-6-methyl-1H-pyrimidin-2-one Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=O)N1)SC(C)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)C

Isomeric SMILES

CC1=C(C(=NC(=O)N1)S[C@@H](C)C(=O)N2CCC(CC2)CC3=CC=CC=C3)C(=O)C

InChI

InChI=1S/C22H27N3O3S/c1-14-19(15(2)26)20(24-22(28)23-14)29-16(3)21(27)25-11-9-18(10-12-25)13-17-7-5-4-6-8-17/h4-8,16,18H,9-13H2,1-3H3,(H,23,24,28)/t16-/m0/s1