Vitas-M small molecule compound
6-[2-(3,4-dimethoxyphenyl)ethyl]-1-(furan-2-ylmethyl)-2-sulfanyl-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(1H)-one
Catalog ID
STK591992
SMILES COc1cc(CCN2CNc3c(C2)c(=O)nc(n3Cc2ccco2)S)ccc1OC
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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 C21H24N4O4S MW 428.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24N4O4S/c1-27-17-6-5-14(10-18(17)28-2)7-8-24-12-16-19(22-13-24)25(21(30)23-20(16)26)11-15-4-3-9-29-15/h3-6,9-10,22H,7-8,11-13H2,1-2H3,(H,23,26,30)InChIKey
WQMAXPVQDRFPLT-UHFFFAOYSA-NSynonyms
727998-33-66(2(34dimethoxyphenyl)ethyl)1(furan2ylmethyl)2sulfanyl5678tetrahydropyrimido(45d)pyrimidin4(1H)one
6(2(34DIMETHOXYPHENYL)ETHYL)1(FURAN2YLMETHYL)2SULFANYLIDENE78DIHYDRO5HPYRIMIDO(45D)PYRIMIDIN4ONE
727998336
COC1=C(C=C(C=C1)CCN2CC3=C(NC2)N(C(=S)NC3=O)CC4=CC=CO4)OC
InChI=1SC21H24N4O4Sc127176514(1018(17)282)7824121619(221324)25(21(30)2320(16)26)11154392915h3691022H781113H212H3(H232630)
MFCD07797165
ZINC000019874664
ZINC19874664
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