Vitas-M small molecule compound
3-(4-methoxyphenyl)-8,8-dimethyl-2-[(2-oxo-2-phenylethyl)sulfanyl]-3,6,8,9-tetrahydro-4H-pyrano[3',4':5,6]pyrido[2,3-d]pyrimidin-4-one
Catalog ID
STK531661
SMILES COc1ccc(cc1)n1c(SCC(=O)c2ccccc2)nc2c(c1=O)cc1c(n2)CC(OC1)(C)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 C27H25N3O4S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S/c1-27(2)14-22-18(15-34-27)13-21-24(28-22)29-26(35-16-23(31)17-7-5-4-6-8-17)30(25(21)32)19-9-11-20(33-3)12-10-19/h4-13H,14-16H2,1-3H3InChIKey
VHUUNNXZHFOHQN-UHFFFAOYSA-NSynonyms
3(4methoxyphenyl)88dimethyl2((2oxo2phenylethyl)sulfanyl)3689tetrahydro4Hpyrano(3456)pyrido(23d)pyrimidin4one
3(4methoxyphenyl)88dimethyl2((2oxo2phenylethyl)thio)89dihydro3Hpyrano(3456)pyrido(23d)pyrimidin4(6H)one
3(4methoxyphenyl)88dimethyl2phenacylsulfanyl69dihydropyrano(34)pyrido(35b)pyrimidin4one
CC1(CC2=C(CO1)C=C3C(=N2)N=C(N(C3=O)C4=CC=C(C=C4)OC)SCC(=O)C5=CC=CC=C5)C
InChI=1SC27H25N3O4Sc127(2)142218(153427)132124(2822)2926(351623(31)177546817)30(25(21)32)1991120(333)121019h413H1416H213H3
MFCD02985380
ZINC000002332640
ZINC02332640
ZINC2332640
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