Vitas-M small molecule compound
ethyl (2Z)-2-(1-acetyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-5-[4-(acetyloxy)-3-ethoxyphenyl]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK701539
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)/c(=C\1/C(=O)N(c3c1cccc3)C(=O)C)/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 C30H27N3O8S MW 589.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O8S/c1-6-39-22-14-18(12-13-21(22)41-17(5)35)25-23(29(38)40-7-2)15(3)31-30-33(25)28(37)26(42-30)24-19-10-8-9-11-20(19)32(16(4)34)27(24)36/h8-14,25H,6-7H2,1-5H3/b26-24-InChIKey
CDDMNFHEBQEPSK-LCUIJRPUSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)c(=C1C(=O)N(c3c1cccc3)C(=O)C)s2
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=C4C5=CC=CC=C5N(C4=O)C(=O)C)S3)C)C(=O)OCC)OC(=O)C
ethyl(2Z)2(1acetyl2oxo12dihydro3Hindol3ylidene)5(4(acetyloxy)3ethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2(1acetyl2oxoindol3ylidene)5(4acetyloxy3ethoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC30H27N3O8Sc1639221418(121321(22)4117(5)35)2523(29(38)4072)15(3)313033(25)28(37)26(4230)241910891120(19)32(16(4)34)27(24)36h81425H67H215H3b2624
MFCD05721142
ZINC000100887641
ZINC000100887643
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.