7-bromanyl-2-[[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one

Systemtic Name: 7-bromanyl-2-[[2-[(3S)-3-methylpiperidin-1-yl]-2-oxidanylidene-ethyl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Openeye Name: 7-bromo-2-[[2-[(3S)-3-methyl-1-piperidyl]-2-oxo-ethyl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one CAS Name: 7-bromo-2-[[[2-[(3S)-3-methyl-1-piperidinyl]-2-oxoethyl]thio]methyl]-4-pyrido[1,2-a]pyrimidinone IUPAC Name: 7-bromo-2-[[2-[(3S)-3-methylpiperidin-1-yl]-2-oxoethyl]sulfanylmethyl]pyrido[1,2-a]pyrimidin-4-one Traditional Name: 7-bromo-2-[[[2-keto-2-[(3S)-3-methylpiperidino]ethyl]thio]methyl]pyrido[1,2-a]pyrimidin-4-one Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CSCC2=CC(=O)N3C=C(C=CC3=N2)Br

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CSCC2=CC(=O)N3C=C(C=CC3=N2)Br

InChI

InChI=1S/C17H20BrN3O2S/c1-12-3-2-6-20(8-12)17(23)11-24-10-14-7-16(22)21-9-13(18)4-5-15(21)19-14/h4-5,7,9,12H,2-3,6,8,10-11H2,1H3/t12-/m0/s1