Vitas-M small molecule compound
ethyl 4-(5-{(Z)-[5-imino-2-(4-methylphenyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}furan-2-yl)benzoate
Catalog ID
STK054933
SMILES CCOC(=O)c1ccc(cc1)c1ccc(o1)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)C
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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 C26H20N4O4S MW 484.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20N4O4S/c1-3-33-25(32)18-10-8-16(9-11-18)21-13-12-19(34-21)14-20-22(27)30-26(28-23(20)31)35-24(29-30)17-6-4-15(2)5-7-17/h4-14,27H,3H2,1-2H3/b20-14-,27-22-InChIKey
UJQUQIDMJWKQGS-AYYXRDHQSA-NSynonyms
CCOC(=O)c1ccc(cc1)c1ccc(o1)C=C1C(=O)N=c2n(C1=N)nc(s2)c1ccc(cc1)C
ethyl4(5((Z)(5imino2(4methylphenyl)7oxo5H(134)thiadiazolo(32a)pyrimidin6(7H)ylidene)methyl)furan2yl)benzoate
MFCD02920544
STK054933
ZINC000008493214
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