Vitas-M small molecule compound
1-benzyl-6-(1-phenylethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Catalog ID
STK585579
SMILES CC(N1CNc2c(C1)c(=O)nc(n2Cc1ccccc1)S)c1ccccc1
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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 C21H22N4OS MW 378.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N4OS/c1-15(17-10-6-3-7-11-17)24-13-18-19(22-14-24)25(21(27)23-20(18)26)12-16-8-4-2-5-9-16/h2-11,15,22H,12-14H2,1H3,(H,23,26,27)InChIKey
RZKOPTQUGLYFBG-UHFFFAOYSA-NSynonyms
879771-35-41benzyl6(1phenylethyl)2sulfanyl5678tetrahydropyrimido(45d)pyrimidin4(1H)one
1benzyl6(1phenylethyl)2sulfanylidene78dihydro5Hpyrimido(45d)pyrimidin4one
879771354
CC(C1=CC=CC=C1)N2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=CC=C4
InChI=1SC21H22N4OSc115(17106371117)24131819(221424)25(21(27)2320(18)26)12168425916h2111522H1214H21H3(H232627)
MFCD07798165
ZINC000019938893
ZINC000019938895
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