Vitas-M small molecule compound
4-{(Z)-[5-imino-7-oxo-2-(pyridin-3-yl)-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenyl thiophene-2-carboxylate
Catalog ID
STL238544
SMILES O=C1N=c2sc(nn2C(=N)/C/1=C/c1ccc(cc1)OC(=O)c1cccs1)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 C22H13N5O3S2 MW 459.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13N5O3S2/c23-18-16(11-13-5-7-15(8-6-13)30-21(29)17-4-2-10-31-17)19(28)25-22-27(18)26-20(32-22)14-3-1-9-24-12-14/h1-12,23H/b16-11-,23-18-InChIKey
UCUYXCMTKBUNJF-CSMICLQESA-NSynonyms
844825-59-8(Z)4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylthiophene2carboxylate
4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenylthiophene2carboxylate
844825598
MFCD04161303
O=C1N=c2sc(nn2C(=N)C1=Cc1ccc(cc1)OC(=O)c1cccs1)c1cccnc1
ZINC000009216471
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