Vitas-M small molecule compound

N-[(2S)-2-(2-hydroxy-4-oxoquinazolin-3(4H)-yl)-4-(methylsulfanyl)butanoyl]-beta-alanine

Catalog ID
STL534487
SMILES CSCC[C@H](n1c(O)nc2c(c1=O)cccc2)C(=O)NCCC(=O)O

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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 C16H19N3O5S MW 365.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O5S/c1-25-9-7-12(14(22)17-8-6-13(20)21)19-15(23)10-4-2-3-5-11(10)18-16(19)24/h2-5,12H,6-9H2,1H3,(H,17,22)(H,18,24)(H,20,21)/t12-/m0/s1
InChIKey
XRQASEJKPLXWQB-LBPRGKRZSA-N
Synonyms
1173668-99-9
(S)3(2(24DIOXO12DIHYDROQUINAZOLIN3(4H)YL)4(METHYLTHIO)BUTANAMIDO)PROPANOICACID
1173668999
1790829
3(((2~(S))2(24dioxo1~(H)quinazolin3yl)4methylsulfanylbutanoyl)amino)propanoicacid
InChI=1SC16H19N3O5Sc1259712(14(22)178613(20)21)1915(23)10423511(10)1816(19)24h2512H69H21H3(H1722)(H1824)(H2021)t12m0s1
N((2S)2(2hydroxy4oxoquinazolin3(4H)yl)4(methylsulfanyl)butanoyl)betaalanine
ZINC000008971910
ZINC8971910

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Available files

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