Vitas-M small molecule compound
methyl (2Z)-[5-amino-6-cyano-8-(dimethylcarbamoyl)-3-oxo-7-(pyridin-3-yl)-7H-[1,3]thiazolo[3,2-a]pyridin-2(3H)-ylidene]ethanoate
Catalog ID
STL485355
SMILES COC(=O)/C=c/1\sc2=C(C(=O)N(C)C)C(C(=C(n2c1=O)N)C#N)c1cccnc1
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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 C19H17N5O4S MW 411.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17N5O4S/c1-23(2)18(27)15-14(10-5-4-6-22-9-10)11(8-20)16(21)24-17(26)12(29-19(15)24)7-13(25)28-3/h4-7,9,14H,21H2,1-3H3/b12-7-InChIKey
BHZJFUULHZJAGY-GHXNOFRVSA-NSynonyms
CN(C)C(=O)C1=C2N(C(=C(C1C3=CN=CC=C3)C#N)N)C(=O)C(=CC(=O)OC)S2
COC(=O)C=c1sc2=C(C(=O)N(C)C)C(C(=C(n2c1=O)N)C#N)c1cccnc1
InChI=1SC19H17N5O4Sc123(2)18(27)1514(1054622910)11(820)16(21)2417(26)12(2919(15)24)713(25)283h47914H21H213H3b127
methyl(2Z)(5amino6cyano8(dimethylcarbamoyl)3oxo7(pyridin3yl)7H(13)thiazolo(32a)pyridin2(3H)ylidene)ethanoate
METHYL(2Z)2(5AMINO6CYANO8(DIMETHYLCARBAMOYL)3OXO7PYRIDIN3YL7H(13)THIAZOLO(32A)PYRIDIN2YLIDENE)ACETATE
MFCD08273218
ZINC000006712196
ZINC000006712200
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