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 3-methylbenzoate
Catalog ID
STL238875
SMILES Cc1cccc(c1)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 C25H17N5O3S MW 467.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H17N5O3S/c1-15-4-2-5-17(12-15)24(32)33-19-9-7-16(8-10-19)13-20-21(26)30-25(28-22(20)31)34-23(29-30)18-6-3-11-27-14-18/h2-14,26H,1H3/b20-13-,26-21-InChIKey
CGQLBERSBQHGHJ-QCPHNCPVSA-NSynonyms
844460-87-3(Z)4((5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl3methylbenzoate
4((Z)(5imino7oxo2(pyridin3yl)5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)phenyl3methylbenzoate
844460873
Cc1cccc(c1)C(=O)Oc1ccc(cc1)C=C1C(=O)N=c2n(C1=N)nc(s2)c1cccnc1
MFCD04157625
ZINC000009192379
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