Vitas-M small molecule compound
propan-2-yl (2Z)-7-methyl-3-oxo-2-[2-oxo-1-(prop-2-en-1-yl)-1,2-dihydro-3H-indol-3-ylidene]-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK814150
SMILES C=CCN1C(=O)/C(=c/2\sc3=NC(=C(C(n3c2=O)c2cccs2)C(=O)OC(C)C)C)/c2c1cccc2
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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 C26H23N3O4S2 MW 505.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4S2/c1-5-12-28-17-10-7-6-9-16(17)20(23(28)30)22-24(31)29-21(18-11-8-13-34-18)19(25(32)33-14(2)3)15(4)27-26(29)35-22/h5-11,13-14,21H,1,12H2,2-4H3/b22-20-InChIKey
XAQFJYYYBKXMKJ-XDOYNYLZSA-NSynonyms
618077-80-8(Z)isopropyl2(1allyl2oxoindolin3ylidene)7methyl3oxo5(thiophen2yl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
618077808
C=CCN1C(=O)C(=c2sc3=NC(=C(C(n3c2=O)c2cccs2)C(=O)OC(C)C)C)c2c1cccc2
CC1=C(C(N2C(=O)C(=C3C4=CC=CC=C4N(C3=O)CC=C)SC2=N1)C5=CC=CS5)C(=O)OC(C)C
InChI=1SC26H23N3O4S2c151228171076916(17)20(23(28)30)2224(31)2921(18118133418)19(25(32)3314(2)3)15(4)2726(29)3522h511131421H112H224H3b2220
ISOPROPYL2(1ALLYL2OXOINDOLIN3YLIDENE)7METHYL3OXO5(THIOPHEN2YL)35DIHYDRO2HTHIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03666175
propan2yl(2Z)7methyl3oxo2(2oxo1(prop2en1yl)12dihydro3Hindol3ylidene)5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
propan2yl(2Z)7methyl3oxo2(2oxo1prop2enylindol3ylidene)5thiophen2yl5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000002376035
ZINC000002376038
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