Vitas-M small molecule compound
1-benzyl-6-(butan-2-yl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Catalog ID
STK591315
SMILES CCC(N1CNc2c(C1)c(=O)nc(n2Cc1ccccc1)S)C
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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 C17H22N4OS MW 330.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H22N4OS/c1-3-12(2)20-10-14-15(18-11-20)21(17(23)19-16(14)22)9-13-7-5-4-6-8-13/h4-8,12,18H,3,9-11H2,1-2H3,(H,19,22,23)InChIKey
JJOXOSLUFAESLU-UHFFFAOYSA-NSynonyms
879564-09-71benzyl6(butan2yl)2sulfanyl5678tetrahydropyrimido(45d)pyrimidin4(1H)one
1benzyl6butan2yl2sulfanylidene78dihydro5Hpyrimido(45d)pyrimidin4one
879564097
CCC(C)N1CC2=C(NC1)N(C(=S)NC2=O)CC3=CC=CC=C3
InChI=1SC17H22N4OSc1312(2)20101415(181120)21(17(23)1916(14)22)9137546813h481218H3911H212H3(H192223)
MFCD07794342
ZINC000019938903
ZINC000019938905
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