Vitas-M small molecule compound
ethyl N-({[3-(4-methylphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)glycinate
Catalog ID
STL057960
SMILES CCOC(=O)CNC(=O)CSc1nc2ccccc2c(=O)n1c1ccc(cc1)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 C21H21N3O4S MW 411.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21N3O4S/c1-3-28-19(26)12-22-18(25)13-29-21-23-17-7-5-4-6-16(17)20(27)24(21)15-10-8-14(2)9-11-15/h4-11H,3,12-13H2,1-2H3,(H,22,25)InChIKey
HJHMXJSQZNPPLA-UHFFFAOYSA-NSynonyms
CCOC(=O)CNC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C
ETHYL2((2(3(4METHYLPHENYL)4OXOQUINAZOLIN2YL)SULFANYLACETYL)AMINO)ACETATE
ETHYL2(2((4OXO3(PTOLYL)34DIHYDROQUINAZOLIN2YL)THIO)ACETAMIDO)ACETATE
ethylN(((3(4methylphenyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)glycinate
InChI=1SC21H21N3O4Sc132819(26)122218(25)1329212317754616(17)20(27)24(21)1510814(2)91115h411H31213H212H3(H2225)
MFCD03473978
ZINC000002370997
ZINC02370997
ZINC2370997
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