Vitas-M small molecule compound
ethyl 4-[(7Z)-7-benzylidene-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Catalog ID
STK859899
SMILES CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1ccccc1)/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 C21H19N3O3S MW 393.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19N3O3S/c1-2-27-20(26)16-8-10-17(11-9-16)23-13-22-21-24(14-23)19(25)18(28-21)12-15-6-4-3-5-7-15/h3-12H,2,13-14H2,1H3/b18-12-InChIKey
SSMAYPDDAHMSIP-PDGQHHTCSA-NSynonyms
690694-99-6(Z)ethyl4(7benzylidene6oxo67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
690694996
CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC=CC=C4)S3
CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1ccccc1)s2
ETHYL4((7Z)7BENZYLIDENE6OXO24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOATE
ethyl4((7Z)7benzylidene6oxo67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
InChI=1SC21H19N3O3Sc122720(26)1681017(11916)2313222124(1423)19(25)18(2821)12156435715h312H21314H21H3b1812
MFCD03682967
ZINC000001128254
ZINC01128254
ZINC1128254
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