Vitas-M small molecule compound
ethyl [(3-benzyl-4-oxo-3,4,6,7,8,9-hexahydropyrimido[4,5-b]quinolin-2-yl)sulfanyl]acetate
Catalog ID
STK524869
SMILES CCOC(=O)CSc1nc2nc3CCCCc3cc2c(=O)n1Cc1ccccc1
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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 C22H23N3O3S MW 409.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3S/c1-2-28-19(26)14-29-22-24-20-17(12-16-10-6-7-11-18(16)23-20)21(27)25(22)13-15-8-4-3-5-9-15/h3-5,8-9,12H,2,6-7,10-11,13-14H2,1H3InChIKey
NAIPONAZKJMQMG-UHFFFAOYSA-NSynonyms
CCOC(=O)CSC1=NC2=NC3=C(CCCC3)C=C2C(=O)N1CC4=CC=CC=C4
ethyl((3benzyl4oxo346789hexahydropyrimido(45b)quinolin2yl)sulfanyl)acetate
ethyl2((3benzyl4oxo346789hexahydropyrimido(45b)quinolin2yl)thio)acetate
ethyl2((3benzyl4oxo6789tetrahydropyrimido(45b)quinolin2yl)sulfanyl)acetate
InChI=1SC22H23N3O3Sc122819(26)142922242017(121610671118(16)2320)21(27)25(22)13158435915h358912H26710111314H21H3
MFCD01960515
ZINC000002290050
ZINC02290050
ZINC2290050
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