Vitas-M small molecule compound
ethyl (2Z)-5-(4-ethoxyphenyl)-2-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL438689
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCC)c(=O)/c(=C/c1cc(n(c1C)c1ccc(cc1)F)C)/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 C31H30FN3O4S MW 559.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30FN3O4S/c1-6-38-25-14-8-21(9-15-25)28-27(30(37)39-7-2)19(4)33-31-35(28)29(36)26(40-31)17-22-16-18(3)34(20(22)5)24-12-10-23(32)11-13-24/h8-17,28H,6-7H2,1-5H3/b26-17-InChIKey
RYFNLCMIEZCRSJ-ONUIUJJFSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OCC)c(=O)c(=Cc1cc(n(c1C)c1ccc(cc1)F)C)s2
CCOC1=CC=C(C=C1)C2C(=C(N=C3N2C(=O)C(=CC4=C(N(C(=C4)C)C5=CC=C(C=C5)F)C)S3)C)C(=O)OCC
ethyl(2Z)5(4ethoxyphenyl)2((1(4fluorophenyl)25dimethyl1Hpyrrol3yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ETHOXYPHENYL)2((1(4FLUOROPHENYL)25DIMETHYLPYRROL3YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H30FN3O4Sc16382514821(91525)2827(30(37)3972)19(4)333135(28)29(36)26(4031)17221618(3)34(20(22)5)24121023(32)111324h81728H67H215H3b2617
MFCD06242093
ZINC000008695565
ZINC000008695566
Check stock
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Check stock on Vitas-MAvailable files
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