Vitas-M small molecule compound
(2S)-({[(9-oxo-1,2,3,9-tetrahydropyrrolo[2,1-b]quinazolin-7-yl)oxy]acetyl}amino)(phenyl)ethanoic acid
Catalog ID
STL535349
SMILES O=C(N[C@@H](c1ccccc1)C(=O)O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1
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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 C21H19N3O5 MW 393.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O5/c25-18(23-19(21(27)28)13-5-2-1-3-6-13)12-29-14-8-9-16-15(11-14)20(26)24-10-4-7-17(24)22-16/h1-3,5-6,8-9,11,19H,4,7,10,12H2,(H,23,25)(H,27,28)/t19-/m0/s1InChIKey
SGDCLAPNGOHVOT-IBGZPJMESA-NSynonyms
1014038-20-0(2~(S))2((2((9oxo23dihydro1~(H)pyrrolo(21b)quinazolin7yl)oxy)acetyl)amino)2phenylaceticacid
(2S)((((9oxo1239tetrahydropyrrolo(21b)quinazolin7yl)oxy)acetyl)amino)(phenyl)ethanoicacid
(S)2(2((9oxo1239tetrahydropyrrolo(21b)quinazolin7yl)oxy)acetamido)2phenylaceticacid
1014038200
17572025
InChI=1SC21H19N3O5c2518(2319(21(27)28)135213613)122914891615(1114)20(26)24104717(24)2216h1356891119H471012H2(H2325)(H2728)t19m0s1
O=C(N(C@@H)(c1ccccc1)C(=O)O)COc1ccc2c(c1)c(=O)n1c(n2)CCC1
ZINC000012901038
ZINC12901038
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