Vitas-M small molecule compound
2-methylpropyl (2E)-4-methyl-2-{[(7-methyl-4-oxo-4H-chromen-2-yl)carbonyl]imino}-2,3-dihydro-1,3-thiazole-5-carboxylate
Catalog ID
STK849334
SMILES CC(COC(=O)c1s/c(=N/C(=O)c2cc(=O)c3c(o2)cc(cc3)C)/[nH]c1C)C
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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 C20H20N2O5S MW 400.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N2O5S/c1-10(2)9-26-19(25)17-12(4)21-20(28-17)22-18(24)16-8-14(23)13-6-5-11(3)7-15(13)27-16/h5-8,10H,9H2,1-4H3,(H,21,22,24)InChIKey
RTWARDTTWLGDSO-UHFFFAOYSA-NSynonyms
873081-30-22methylpropyl(2E)4methyl2(((7methyl4oxo4Hchromen2yl)carbonyl)imino)23dihydro13thiazole5carboxylate
873081302
CC(COC(=O)c1sc(=NC(=O)c2cc(=O)c3c(o2)cc(cc3)C)(nH)c1C)C
CC1=CC2=C(C=C1)C(=O)C=C(O2)C(=O)NC3=NC(=C(S3)C(=O)OCC(C)C)C
InChI=1SC20H20N2O5Sc110(2)92619(25)1712(4)2120(2817)2218(24)16814(23)136511(3)715(13)2716h5810H9H214H3(H212224)
MFCD18169729
ZINC000009058694
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