Vitas-M small molecule compound

2-(acetylamino)-3-[(6-methoxy-2-methylquinolin-4-yl)sulfanyl]propanoate

Catalog ID
STL003849
SMILES COc1ccc2c(c1)c(SCC(C(=O)[O-])NC(=O)C)cc(n2)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 C16H17N2O4S MW 333.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H18N2O4S/c1-9-6-15(23-8-14(16(20)21)18-10(2)19)12-7-11(22-3)4-5-13(12)17-9/h4-7,14H,8H2,1-3H3,(H,18,19)(H,20,21)/p-1
InChIKey
ZCSIKQWFDTYDMJ-UHFFFAOYSA-M
Synonyms

2(acetylamino)3((6methoxy2methylquinolin4yl)sulfanyl)propanoate
2ACETAMIDO3(6METHOXY2METHYLQUINOLIN4YL)SULFANYLPROPANOATE
CC1=NC2=C(C=C(C=C2)OC)C(=C1)SCC(C(=O)(O))NC(=O)C
COc1ccc2c(c1)c(SCC(C(=O)(O))NC(=O)C)cc(n2)C
COc1ccc2c(c1)c(SCC(C(=O)(O))NC(=O)C)cc(n2)C(K+)
InChI=1SC16H18N2O4Sc19615(23814(16(20)21)1810(2)19)12711(223)4513(12)179h4714H8H213H3(H1819)(H2021)p1
potassium2acetamido3((6methoxy2methylquinolin4yl)thio)propanoate

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Available files

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