Vitas-M small molecule compound
ethyl 4-[(7Z)-7-[(5-iodofuran-2-yl)methylidene]-6-oxo-6,7-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-3(4H)-yl]benzoate
Catalog ID
STK859796
SMILES CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)/c(=C/c1ccc(o1)I)/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 C19H16IN3O4S MW 509.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16IN3O4S/c1-2-26-18(25)12-3-5-13(6-4-12)22-10-21-19-23(11-22)17(24)15(28-19)9-14-7-8-16(20)27-14/h3-9H,2,10-11H2,1H3/b15-9-InChIKey
ADLXGZJQQDUNHX-DHDCSXOGSA-NSynonyms
(Z)ethyl4(7((5iodofuran2yl)methylene)6oxo67dihydro2Hthiazolo(32a)(135)triazin3(4H)yl)benzoate
CCOC(=O)C1=CC=C(C=C1)N2CN=C3N(C2)C(=O)C(=CC4=CC=C(O4)I)S3
CCOC(=O)c1ccc(cc1)N1CN=c2n(C1)c(=O)c(=Cc1ccc(o1)I)s2
ETHYL4((7Z)7((5IODOFURAN2YL)METHYLIDENE)6OXO24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN3YL)BENZOATE
ethyl4((7Z)7((5iodofuran2yl)methylidene)6oxo67dihydro2H(13)thiazolo(32a)(135)triazin3(4H)yl)benzoate
InChI=1SC19H16IN3O4Sc122618(25)123513(6412)2210211923(1122)17(24)15(2819)9147816(20)2714h39H21011H21H3b159
MFCD02998272
ZINC000001246919
ZINC01246919
ZINC1246919
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