Vitas-M small molecule compound
ethyl (2E)-2-{[5-(4-chloro-2-nitrophenyl)furan-2-yl]methylidene}-5-(4-methoxynaphthalen-1-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK675174
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c3c1cccc3)OC)c(=O)/c(=C\c1ccc(o1)c1ccc(cc1[N+](=O)[O-])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 C32H24ClN3O7S MW 630.08 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H24ClN3O7S/c1-4-42-31(38)28-17(2)34-32-35(29(28)22-12-14-25(41-3)21-8-6-5-7-20(21)22)30(37)27(44-32)16-19-10-13-26(43-19)23-11-9-18(33)15-24(23)36(39)40/h5-16,29H,4H2,1-3H3/b27-16+InChIKey
NIJSPWQZUBCPPR-JVWAILMASA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c3c1cccc3)OC)c(=O)c(=Cc1ccc(o1)c1ccc(cc1(N+)(=O)(O))Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C4=CC=CC=C34)OC)C(=O)C(=CC5=CC=C(O5)C6=C(C=C(C=C6)Cl)(N+)(=O)(O))S2)C
ethyl(2E)2((5(4chloro2nitrophenyl)furan2yl)methylidene)5(4methoxynaphthalen1yl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)2((5(4CHLORO2NITROPHENYL)FURAN2YL)METHYLIDENE)5(4METHOXYNAPHTHALEN1YL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H24ClN3O7Sc144231(38)2817(2)343235(29(28)22121425(413)21865720(21)22)30(37)27(4432)1619101326(4319)2311918(33)1524(23)36(39)40h51629H4H213H3b2716+
MFCD01571408
ZINC000150363861
ZINC000150363864
Check stock
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Check stock on Vitas-MAvailable files
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