Vitas-M small molecule compound
ethyl (2Z)-5-(3,4-dimethoxyphenyl)-2-[(2-ethoxynaphthalen-1-yl)methylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK673858
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1c(OCC)ccc3c1cccc3)/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 C31H30N2O6S MW 558.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H30N2O6S/c1-6-38-23-14-12-19-10-8-9-11-21(19)22(23)17-26-29(34)33-28(20-13-15-24(36-4)25(16-20)37-5)27(30(35)39-7-2)18(3)32-31(33)40-26/h8-17,28H,6-7H2,1-5H3/b26-17-InChIKey
PGPPPXKIUCRQQC-ONUIUJJFSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1c(OCC)ccc3c1cccc3)s2
CCOC1=C(C2=CC=CC=C2C=C1)C=C3C(=O)N4C(C(=C(N=C4S3)C)C(=O)OCC)C5=CC(=C(C=C5)OC)OC
ethyl(2Z)5(34dimethoxyphenyl)2((2ethoxynaphthalen1yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(34DIMETHOXYPHENYL)2((2ETHOXYNAPHTHALEN1YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H30N2O6Sc16382314121910891121(19)22(23)172629(34)3328(20131524(364)25(1620)375)27(30(35)3972)18(3)3231(33)4026h81728H67H215H3b2617
MFCD01155402
ZINC000002921095
ZINC000002921099
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