Vitas-M small molecule compound
5-(4-methoxyphenyl)-7,9-dimethyl-3-[(2-methylprop-2-en-1-yl)sulfanyl]pyrimido[5,4-e][1,2,4]triazolo[4,3-c]pyrimidine-8,10(7H,9H)-dione
Catalog ID
STK638728
SMILES COc1ccc(cc1)c1nc2n(C)c(=O)n(c(=O)c2c2n1c(SCC(=C)C)nn2)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 C20H20N6O3S MW 424.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N6O3S/c1-11(2)10-30-19-23-22-17-14-16(24(3)20(28)25(4)18(14)27)21-15(26(17)19)12-6-8-13(29-5)9-7-12/h6-9H,1,10H2,2-5H3InChIKey
JTVKEYVURGWPIQ-UHFFFAOYSA-NSynonyms
1010912-95-41010912954
5(4methoxyphenyl)79dimethyl3((2methylallyl)thio)pyrimido(54e)(124)triazolo(43c)pyrimidine810(7H9H)dione
5(4methoxyphenyl)79dimethyl3((2methylprop2en1yl)sulfanyl)pyrimido(54e)(124)triazolo(43c)pyrimidine810(7H9H)dione
CC(=C)CSC1=NN=C2N1C(=NC3=C2C(=O)N(C(=O)N3C)C)C4=CC=C(C=C4)OC
InChI=1SC20H20N6O3Sc111(2)1030192322171416(24(3)20(28)25(4)18(14)27)2115(26(17)19)126813(295)9712h69H110H225H3
MFCD12200647
ZINC000012388841
ZINC12388841
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