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 4-methoxybenzoate
Catalog ID
STL232242
SMILES COc1ccc(cc1)C(=O)Oc1ccc(cc1)/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 C25H17N5O4S MW 483.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N5O4S/c1-33-18-10-6-16(7-11-18)24(32)34-19-8-4-15(5-9-19)13-20-21(26)30-25(28-22(20)31)35-23(29-30)17-3-2-12-27-14-17/h2-14,26H,1H3/b20-13-,26-21-InChIKey
KPHBJKPQIFCCBQ-QCPHNCPVSA-NSynonyms
847181-33-3(Z)4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4methoxybenzoate
4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl4methoxybenzoate
847181333
COc1ccc(cc1)C(=O)Oc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04184244
ZINC000009159857
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