Vitas-M small molecule compound
methyl 4-[({[3-(4-fluorobenzyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL014777
SMILES COC(=O)c1ccc(cc1)NC(=O)CSc1nc2ccccc2c(=O)n1Cc1ccc(cc1)F
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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 C25H20FN3O4S MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20FN3O4S/c1-33-24(32)17-8-12-19(13-9-17)27-22(30)15-34-25-28-21-5-3-2-4-20(21)23(31)29(25)14-16-6-10-18(26)11-7-16/h2-13H,14-15H2,1H3,(H,27,30)InChIKey
XPINLUOWEKXIJY-UHFFFAOYSA-NSynonyms
COC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)F
InChI=1SC25H20FN3O4Sc13324(32)1781219(13917)2722(30)1534252821532420(21)23(31)29(25)141661018(26)11716h213H1415H21H3(H2730)
methyl4((((3(4fluorobenzyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
methyl4((2(3((4fluorophenyl)methyl)4oxoquinazolin2yl)sulfanylacetyl)amino)benzoate
MFCD04713509
ZINC000051357574
ZINC51357574
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