Vitas-M small molecule compound
ethyl (2Z)-7-methyl-2-[3-(naphthalen-1-ylmethoxy)benzylidene]-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK325748
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1cccc(c1)OCc1cccc3c1cccc3)/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 C32H26N2O4S2 MW 566.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26N2O4S2/c1-3-37-31(36)28-20(2)33-32-34(29(28)26-15-8-16-39-26)30(35)27(40-32)18-21-9-6-13-24(17-21)38-19-23-12-7-11-22-10-4-5-14-25(22)23/h4-18,29H,3,19H2,1-2H3/b27-18-InChIKey
NQWCAYQMDMTOQC-IMRQLAEWSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1cccc(c1)OCc1cccc3c1cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CS3)C(=O)C(=CC4=CC(=CC=C4)OCC5=CC=CC6=CC=CC=C65)S2)C
ETHYL(2Z)7METHYL2((3(NAPHTHALEN1YLMETHOXY)PHENYL)METHYLIDENE)3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)7METHYL2(3(NAPHTHALEN1YLMETHOXY)BENZYLIDENE)3OXO5(THIOPHEN2YL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC32H26N2O4S2c133731(36)2820(2)333234(29(28)26158163926)30(35)27(4032)1821961324(1721)381923127112210451425(22)23h41829H319H212H3b2718
MFCD02378708
ZINC000100618155
ZINC000100618159
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