Vitas-M small molecule compound
methyl (2Z)-[5-amino-6-cyano-8-(methylcarbamoyl)-3-oxo-7-(thiophen-2-yl)-7H-[1,3]thiazolo[3,2-a]pyridin-2(3H)-ylidene]ethanoate
Catalog ID
STL485340
SMILES CNC(=O)C1=c2s/c(=C\C(=O)OC)/c(=O)n2C(=C(C1c1cccs1)C#N)N
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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 C17H14N4O4S2 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14N4O4S2/c1-20-15(23)13-12(9-4-3-5-26-9)8(7-18)14(19)21-16(24)10(27-17(13)21)6-11(22)25-2/h3-6,12H,19H2,1-2H3,(H,20,23)/b10-6-InChIKey
ZFWGRHSEKUIMIB-POHAHGRESA-NSynonyms
CNC(=O)C1=C2N(C(=C(C1C3=CC=CS3)C#N)N)C(=O)C(=CC(=O)OC)S2
CNC(=O)C1=c2sc(=CC(=O)OC)c(=O)n2C(=C(C1c1cccs1)C#N)N
InChI=1SC17H14N4O4S2c12015(23)1312(9435269)8(718)14(19)2116(24)10(2717(13)21)611(22)252h3612H19H212H3(H2023)b106
methyl(2Z)(5amino6cyano8(methylcarbamoyl)3oxo7(thiophen2yl)7H(13)thiazolo(32a)pyridin2(3H)ylidene)ethanoate
METHYL(2Z)2(5AMINO6CYANO8(METHYLCARBAMOYL)3OXO7THIOPHEN2YL7H(13)THIAZOLO(32A)PYRIDIN2YLIDENE)ACETATE
MFCD07755394
ZINC000003769980
ZINC000003769982
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