Vitas-M small molecule compound
methyl 2-[(3E)-3-{hydroxy[4-(propan-2-yloxy)phenyl]methylidene}-4,5-dioxo-2-(pyridin-3-yl)pyrrolidin-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Catalog ID
STK591890
SMILES COC(=O)c1sc(nc1C)N1C(=O)C(=O)/C(=C(\c2ccc(cc2)OC(C)C)/O)/C1c1cccnc1
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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 C25H23N3O6S MW 493.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O6S/c1-13(2)34-17-9-7-15(8-10-17)20(29)18-19(16-6-5-11-26-12-16)28(23(31)21(18)30)25-27-14(3)22(35-25)24(32)33-4/h5-13,19,29H,1-4H3/b20-18+InChIKey
SYSCGTICYKCBPW-CZIZESTLSA-NSynonyms
CC1=C(SC(=N1)N2C(C(=C(C3=CC=C(C=C3)OC(C)C)O)C(=O)C2=O)C4=CN=CC=C4)C(=O)OC
COC(=O)c1sc(nc1C)N1C(=O)C(=O)C(=C(c2ccc(cc2)OC(C)C)O)C1c1cccnc1
InChI=1SC25H23N3O6Sc113(2)34179715(81017)20(29)1819(166511261216)28(23(31)21(18)30)252714(3)22(3525)24(32)334h5131929H14H3b2018+
methyl2((3E)3(hydroxy(4(propan2yloxy)phenyl)methylidene)45dioxo2(pyridin3yl)pyrrolidin1yl)4methyl13thiazole5carboxylate
METHYL2((4E)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)23DIOXO5PYRIDIN3YLPYRROLIDIN1YL)4METHYL13THIAZOLE5CARBOXYLATE
MFCD07211145
ZINC000102609505
ZINC000102609509
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