Vitas-M small molecule compound
ethyl (2Z)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-{4-[(furan-2-ylcarbonyl)oxy]phenyl}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK702870
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)c1ccco1)c(=O)/c(=C\1/C(=O)N(c3c1cccc3)CC)/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 C31H25N3O7S MW 583.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25N3O7S/c1-4-33-21-10-7-6-9-20(21)24(27(33)35)26-28(36)34-25(23(30(38)39-5-2)17(3)32-31(34)42-26)18-12-14-19(15-13-18)41-29(37)22-11-8-16-40-22/h6-16,25H,4-5H2,1-3H3/b26-24-InChIKey
KLDVWMTTXCLKPL-LCUIJRPUSA-NSynonyms
(Z)ethyl2(1ethyl2oxoindolin3ylidene)5(4((furan2carbonyl)oxy)phenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC=C(C=C5)OC(=O)C6=CC=CO6)C1=O
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)c1ccco1)c(=O)c(=C1C(=O)N(c3c1cccc3)CC)s2
ethyl(2Z)2(1ethyl2oxo12dihydro3Hindol3ylidene)5(4((furan2ylcarbonyl)oxy)phenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2(1ethyl2oxoindol3ylidene)5(4(furan2carbonyloxy)phenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC31H25N3O7Sc1433211076920(21)24(27(33)35)2628(36)3425(23(30(38)3952)17(3)3231(34)4226)18121419(151318)4129(37)22118164022h61625H45H213H3b2624
MFCD02993319
ZINC000001760260
ZINC000001760265
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