Vitas-M small molecule compound
methyl 4-[(7Z)-7-(5-methoxy-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Catalog ID
STK606243
SMILES COc1ccc2c(c1)/C(=c\1/sc3=NCN(Cn3c1=O)c1ccc(cc1)C(=O)OC)/C(=O)N2
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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 C22H18N4O5S MW 450.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N4O5S/c1-30-14-7-8-16-15(9-14)17(19(27)24-16)18-20(28)26-11-25(10-23-22(26)32-18)13-5-3-12(4-6-13)21(29)31-2/h3-9H,10-11H2,1-2H3,(H,24,27)/b18-17-InChIKey
GRUCATPRPGGGTJ-ZCXUNETKSA-NSynonyms
903193-37-3(Z)methyl4(7(5methoxy2oxoindolin3ylidene)6oxo67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
903193373
COC1=CC2=C(C=C1)NC(=O)C2=C3C(=O)N4CN(CN=C4S3)C5=CC=C(C=C5)C(=O)OC
COc1ccc2c(c1)C(=c1sc3=NCN(Cn3c1=O)c1ccc(cc1)C(=O)OC)C(=O)N2
InChI=1SC22H18N4O5Sc13014781615(914)17(19(27)2416)1820(28)261125(102322(26)3218)135312(4613)21(29)312h39H1011H212H3(H2427)b1817
methyl4((7Z)7(5methoxy2oxo12dihydro3Hindol3ylidene)6oxo67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
methyl4((7Z)7(5methoxy2oxo1Hindol3ylidene)6oxo24dihydro(13)thiazolo(32a)(135)triazin3yl)benzoate
MFCD08287316
ZINC000009409682
ZINC09409682
ZINC9409682
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