Vitas-M small molecule compound
ethyl (2Z)-2-(3-ethoxybenzylidene)-7-methyl-3-oxo-5-[2-(propan-2-yloxy)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL388078
SMILES CCOc1cccc(c1)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccccc1OC(C)C)C(=O)OCC)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 C28H30N2O5S MW 506.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O5S/c1-6-33-20-12-10-11-19(15-20)16-23-26(31)30-25(21-13-8-9-14-22(21)35-17(3)4)24(27(32)34-7-2)18(5)29-28(30)36-23/h8-17,25H,6-7H2,1-5H3/b23-16-InChIKey
WAGYGTBDFABNBU-KQWNVCNZSA-NSynonyms
CCOC1=CC=CC(=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC=CC=C4OC(C)C
CCOc1cccc(c1)C=c1sc2=NC(=C(C(n2c1=O)c1ccccc1OC(C)C)C(=O)OCC)C
ETHYL(2Z)2((3ETHOXYPHENYL)METHYLIDENE)7METHYL3OXO5(2PROPAN2YLOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(3ethoxybenzylidene)7methyl3oxo5(2(propan2yloxy)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC28H30N2O5Sc16332012101119(1520)162326(31)3025(2113891422(21)3517(3)4)24(27(32)3472)18(5)2928(30)3623h81725H67H215H3b2316
MFCD03166961
ZINC000003770479
ZINC000003770481
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