Vitas-M small molecule compound
2-ethoxy-4-{(Z)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl 4-fluorobenzoate
Catalog ID
STL160784
SMILES CCOc1cc(ccc1OC(=O)c1ccc(cc1)F)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)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 C26H18FN5O4S MW 515.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18FN5O4S/c1-2-35-21-13-15(5-10-20(21)36-25(34)16-6-8-18(27)9-7-16)12-19-22(28)32-26(30-23(19)33)37-24(31-32)17-4-3-11-29-14-17/h3-14,28H,2H2,1H3/b19-12-,28-22-InChIKey
GLQYBVMPQSETPD-YZCMSSDVSA-NSynonyms
847245-81-2(Z)2ethoxy4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4fluorobenzoate
2ethoxy4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4fluorobenzoate
847245812
CCOc1cc(ccc1OC(=O)c1ccc(cc1)F)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04174607
ZINC000009304481
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