Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-5-[4-(acetyloxy)phenyl]-7-methyl-3-oxo-2-(2-oxo-1-propyl-1,2-dihydro-3H-indol-3-ylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK793769
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/1\c3ccccc3N(C1=O)CCC)/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 C30H27N3O6S MW 557.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N3O6S/c1-5-15-32-22-10-8-7-9-21(22)24(27(32)35)26-28(36)33-25(19-11-13-20(14-12-19)39-18(4)34)23(29(37)38-16-6-2)17(3)31-30(33)40-26/h6-14,25H,2,5,15-16H2,1,3-4H3/b26-24-InChIKey
OHNWNALKMQIPFK-LCUIJRPUSA-NSynonyms
(E)allyl5(4acetoxyphenyl)7methyl3oxo2(2oxo1propylindolin3ylidene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
4(7METHYL3OXO2(2OXO1PROPYLBENZO(D)AZOLIN3YLIDENE)6(PROP2ENYLOXYCARBONYL)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN5YL)PHENYLACETATE
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=C1c3ccccc3N(C1=O)CCC)s2
CCCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC=C)C5=CC=C(C=C5)OC(=O)C)C1=O
InChI=1SC30H27N3O6Sc151532221087921(22)24(27(32)35)2628(36)3325(19111320(141219)3918(4)34)23(29(37)381662)17(3)3130(33)4026h61425H251516H2134H3b2624
MFCD03029148
prop2en1yl(2Z)5(4(acetyloxy)phenyl)7methyl3oxo2(2oxo1propyl12dihydro3Hindol3ylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
prop2enyl(2Z)5(4acetyloxyphenyl)7methyl3oxo2(2oxo1propylindol3ylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000097947675
ZINC000097947676
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