Vitas-M small molecule compound
4-[(Z)-(8-ethoxy-4-iminio-2-oxo-2H-pyrimido[2,1-b][1,3]benzothiazol-3(4H)-ylidene)methyl]-2-hydroxyphenolate
Catalog ID
STK591905
SMILES CCOc1ccc2c(c1)sc1=NC(=O)/C(=C\c3ccc(c(c3)O)[O-])/C(=[NH2+])n21
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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 C19H15N3O4S MW 381.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15N3O4S/c1-2-26-11-4-5-13-16(9-11)27-19-21-18(25)12(17(20)22(13)19)7-10-3-6-14(23)15(24)8-10/h3-9,20,23-24H,2H2,1H3/b12-7-,20-17?InChIKey
QJDQMYCYQKIZAB-NHSARVKJSA-NSynonyms
4((Z)(8ethoxy4iminio2oxo2Hpyrimido(21b)(13)benzothiazol3(4H)ylidene)methyl)2hydroxyphenolate
CCOc1ccc2c(c1)sc1=NC(=O)C(=Cc3ccc(c(c3)O)(O))C(=(NH2+))n21
MFCD07203461
ZINC000016993610
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