Vitas-M small molecule compound

ethyl (2Z)-5-(2-chlorophenyl)-2-{[5-(2-methoxy-4-nitrophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK676198
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C/c1ccc(o1)c1ccc(cc1OC)[N+](=O)[O-])/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 C28H22ClN3O7S MW 580.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22ClN3O7S/c1-4-38-27(34)24-15(2)30-28-31(25(24)18-7-5-6-8-20(18)29)26(33)23(40-28)14-17-10-12-21(39-17)19-11-9-16(32(35)36)13-22(19)37-3/h5-14,25H,4H2,1-3H3/b23-14-
InChIKey
ZORRGGKEHBGHGO-UCQKPKSFSA-N
Synonyms

CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1ccc(o1)c1ccc(cc1OC)(N+)(=O)(O))s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3Cl)C(=O)C(=CC4=CC=C(O4)C5=C(C=C(C=C5)(N+)(=O)(O))OC)S2)C
ethyl(2Z)5(2chlorophenyl)2((5(2methoxy4nitrophenyl)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(2CHLOROPHENYL)2((5(2METHOXY4NITROPHENYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(2CHLOROPHENYL)2((5(4NITRO2METHOXYPHENYL)2FURYL)METHYLENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H22ClN3O7Sc143827(34)2415(2)302831(25(24)18756820(18)29)26(33)23(4028)1417101221(3917)1911916(32(35)36)1322(19)373h51425H4H213H3b2314
MFCD01140657
ZINC000002059494
ZINC000002059496

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Available files

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