Vitas-M small molecule compound

propan-2-yl (2Z)-2-(1-ethyl-2-oxo-1,2-dihydro-3H-indol-3-ylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK701523
SMILES CCN1c2ccccc2/C(=c\2/sc3=NC(=C(C(n3c2=O)c2ccccc2)C(=O)OC(C)C)C)/C1=O

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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 C27H25N3O4S MW 487.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25N3O4S/c1-5-29-19-14-10-9-13-18(19)21(24(29)31)23-25(32)30-22(17-11-7-6-8-12-17)20(26(33)34-15(2)3)16(4)28-27(30)35-23/h6-15,22H,5H2,1-4H3/b23-21-
InChIKey
NRPMEDWUTIXCRN-LNVKXUELSA-N
Synonyms

CCN1C2=CC=CC=C2C(=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OC(C)C)C5=CC=CC=C5)C1=O
CCN1c2ccccc2C(=c2sc3=NC(=C(C(n3c2=O)c2ccccc2)C(=O)OC(C)C)C)C1=O
InChI=1SC27H25N3O4Sc152919141091318(19)21(24(29)31)2325(32)3022(17117681217)20(26(33)3415(2)3)16(4)2827(30)3523h61522H5H214H3b2321
MFCD03088554
propan2yl(2Z)2(1ethyl2oxo12dihydro3Hindol3ylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
propan2yl(2Z)2(1ethyl2oxoindol3ylidene)7methyl3oxo5phenyl5H(13)thiazolo(32a)pyrimidine6carboxylate
PROPAN2YL2(1ETHYL2OXO23DIHYDRO1HINDOL3YLIDENE)7METHYL3OXO5PHENYL2H3H5HPYRIMIDO(21B)(13)THIAZOLE6CARBOXYLATE
ZINC000016790973
ZINC000016790975

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.