Vitas-M small molecule compound
4-(5-{(Z)-[5-(2,4-dimethoxyphenyl)-6-(ethoxycarbonyl)-7-methyl-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}furan-2-yl)benzoic acid
Catalog ID
STK522628
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1OC)OC)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1)C(=O)O)/s2
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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 C30H26N2O8S MW 574.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N2O8S/c1-5-39-29(36)25-16(2)31-30-32(26(25)21-12-10-19(37-3)14-23(21)38-4)27(33)24(41-30)15-20-11-13-22(40-20)17-6-8-18(9-7-17)28(34)35/h6-15,26H,5H2,1-4H3,(H,34,35)/b24-15-InChIKey
QQNGCWWEPIXKJC-IWIPYMOSSA-NSynonyms
4(5((Z)(5(24dimethoxyphenyl)6(ethoxycarbonyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidin2(3H)ylidene)methyl)furan2yl)benzoicacid
4(5((Z)(5(24DIMETHOXYPHENYL)6ETHOXYCARBONYL7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDIN2YLIDENE)METHYL)FURAN2YL)BENZOICACID
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1OC)OC)c(=O)c(=Cc1ccc(o1)c1ccc(cc1)C(=O)O)s2
CCOC(=O)C1=C(N=C2N(C1C3=C(C=C(C=C3)OC)OC)C(=O)C(=CC4=CC=C(O4)C5=CC=C(C=C5)C(=O)O)S2)C
InChI=1SC30H26N2O8Sc153929(36)2516(2)313032(26(25)21121019(373)1423(21)384)27(33)24(4130)1520111322(4020)176818(9717)28(34)35h61526H5H214H3(H3435)b2415
MFCD01591809
ZINC000100618577
ZINC000100618580
Check stock
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Check stock on Vitas-MAvailable files
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