Vitas-M small molecule compound

2-(4-benzylpiperidin-1-yl)-8-methyl-4-[4-(methylsulfanyl)phenyl]-1,4-dihydro-6H-pyrimido[1,2-a][1,3,5]triazin-6-one

Catalog ID
STK292334
SMILES CSc1ccc(cc1)C1N=C(Nc2n1c(=O)cc(n2)C)N1CCC(CC1)Cc1ccccc1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C26H29N5OS MW 459.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N5OS/c1-18-16-23(32)31-24(21-8-10-22(33-2)11-9-21)28-25(29-26(31)27-18)30-14-12-20(13-15-30)17-19-6-4-3-5-7-19/h3-11,16,20,24H,12-15,17H2,1-2H3,(H,27,28,29)
InChIKey
HFLAFQSDINRFPS-UHFFFAOYSA-N
Synonyms

2(4benzylpiperidin1yl)8methyl4(4(methylsulfanyl)phenyl)14dihydro6Hpyrimido(12a)(135)triazin6one
2(4BENZYLPIPERIDIN1YL)8METHYL4(4(METHYLTHIO)PHENYL)1HPYRIMIDO(12A)(135)TRIAZIN6(4H)ONE
2(4benzylpiperidin1yl)8methyl4(4methylsulfanylphenyl)49dihydropyrimido(12a)(135)triazin6one
8METHYL4(4METHYLTHIOPHENYL)2(4BENZYLPIPERIDYL)5HYDRO1H4HPYRIMIDINO(21B)135TRIAZIN6ONE
CC1=CC(=O)N2C(N=C(N=C2N1)N3CCC(CC3)CC4=CC=CC=C4)C5=CC=C(C=C5)SC
InChI=1SC26H29N5OSc1181623(32)3124(2181022(332)11921)2825(2926(31)2718)30141220(131530)17196435719h311162024H121517H212H3(H272829)
MFCD09430385
ZINC000009287507
ZINC000009287508

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Available files

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