Vitas-M small molecule compound

ethyl (2Z)-5-[4-(methoxycarbonyl)phenyl]-7-methyl-2-[(2-methyl-2H-chromen-3-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK813196
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(=O)OC)c(=O)/c(=C/C1=Cc3ccccc3OC1C)/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 C29H26N2O6S MW 530.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H26N2O6S/c1-5-36-28(34)24-16(2)30-29-31(25(24)18-10-12-19(13-11-18)27(33)35-4)26(32)23(38-29)15-21-14-20-8-6-7-9-22(20)37-17(21)3/h6-15,17,25H,5H2,1-4H3/b23-15-
InChIKey
UTZIPGJRTDJVNU-HAHDFKILSA-N
Synonyms
611178-06-4
611178064
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(=O)OC)c(=O)c(=CC1=Cc3ccccc3OC1C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C(=O)OC)C(=O)C(=CC4=CC5=CC=CC=C5OC4C)S2)C
ethyl(2Z)5(4(methoxycarbonyl)phenyl)7methyl2((2methyl2Hchromen3yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4METHOXYCARBONYLPHENYL)7METHYL2((2METHYL2HCHROMEN3YL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(4(METHOXYCARBONYL)PHENYL)7METHYL2((2METHYL2HCHROMEN3YL)METHYLENE)3OXO35DIHYDRO2HTHIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H26N2O6Sc153628(34)2416(2)302931(25(24)18101219(131118)27(33)354)26(32)23(3829)15211420867922(20)3717(21)3h6151725H5H214H3b2315
MFCD03517778
ZINC000002680450
ZINC000100845612

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Available files

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