Vitas-M small molecule compound
ethyl 4-[(7Z)-7-(3-chlorobenzylidene)-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Catalog ID
STK724982
SMILES CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1cccc(c1)Cl)/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 C21H18ClN3O3S MW 427.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN3O3S/c1-2-28-20(27)15-6-8-17(9-7-15)24-12-23-21-25(13-24)19(26)18(29-21)11-14-4-3-5-16(22)10-14/h3-11H,2,12-13H2,1H3/b18-11-InChIKey
FAHLCTDKCWIJAP-WQRHYEAKSA-NSynonyms
749214-42-4(Z)ethyl4(7(3chlorobenzylidene)6oxo67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
749214424
CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC(=CC=C4)Cl)S3
CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1cccc(c1)Cl)s2
ETHYL4((7Z)7((3CHLOROPHENYL)METHYLIDENE)6OXO24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOATE
ethyl4((7Z)7(3chlorobenzylidene)6oxo67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
InChI=1SC21H18ClN3O3Sc122820(27)156817(9715)2412232125(1324)19(26)18(2921)111443516(22)1014h311H21213H21H3b1811
MFCD03683673
ZINC000002240557
ZINC02240557
ZINC2240557
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