Vitas-M small molecule compound
3-(butan-2-yl)-2-{[2-(3,4-dihydroquinolin-1(2H)-yl)-2-oxoethyl]sulfanyl}-6-methyl-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
Catalog ID
STL093747
SMILES CCC(n1c(SCC(=O)N2CCCc3c2cccc3)nc2c(c1=O)[nH]c(c2)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 C22H26N4O2S MW 410.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N4O2S/c1-4-15(3)26-21(28)20-17(12-14(2)23-20)24-22(26)29-13-19(27)25-11-7-9-16-8-5-6-10-18(16)25/h5-6,8,10,12,15,23H,4,7,9,11,13H2,1-3H3InChIKey
VXCODXYZRNYGLT-UHFFFAOYSA-NSynonyms
3(butan2yl)2((2(34dihydroquinolin1(2H)yl)2oxoethyl)sulfanyl)6methyl35dihydro4Hpyrrolo(32d)pyrimidin4one
3butan2yl2(2(34dihydro2Hquinolin1yl)2oxoethyl)sulfanyl6methyl5Hpyrrolo(32d)pyrimidin4one
CCC(C)N1C(=O)C2=C(C=C(N2)C)N=C1SCC(=O)N3CCCC4=CC=CC=C43
CCC(n1c(SCC(=O)N2CCCc3c2cccc3)nc2c(c1=O)(nH)c(c2)C)C
InChI=1SC22H26N4O2Sc1415(3)2621(28)2017(1214(2)2320)2422(26)291319(27)251179168561018(16)25h56810121523H4791113H213H3
MFCD18787881
ZINC000067238656
ZINC000067238658
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