Vitas-M small molecule compound

methyl 5-chloro-2-[({[3-(2-methylpropyl)-4-oxo-3,4-dihydroquinazolin-2-yl]sulfanyl}acetyl)amino]benzoate

Catalog ID
STL014700
SMILES COC(=O)c1cc(Cl)ccc1NC(=O)CSc1nc2ccccc2c(=O)n1CC(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 C22H22ClN3O4S MW 459.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O4S/c1-13(2)11-26-20(28)15-6-4-5-7-17(15)25-22(26)31-12-19(27)24-18-9-8-14(23)10-16(18)21(29)30-3/h4-10,13H,11-12H2,1-3H3,(H,24,27)
InChIKey
BYWCJEVSYZKOFO-UHFFFAOYSA-N
Synonyms

CC(C)CN1C(=O)C2=CC=CC=C2N=C1SCC(=O)NC3=C(C=C(C=C3)Cl)C(=O)OC
InChI=1SC22H22ClN3O4Sc113(2)112620(28)15645717(15)2522(26)311219(27)24189814(23)1016(18)21(29)303h41013H1112H213H3(H2427)
methyl5chloro2((((3(2methylpropyl)4oxo34dihydroquinazolin2yl)sulfanyl)acetyl)amino)benzoate
methyl5chloro2((2(3(2methylpropyl)4oxoquinazolin2yl)sulfanylacetyl)amino)benzoate
MFCD18186629
ZINC000051357474
ZINC51357474

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Available files

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