Vitas-M small molecule compound
ethyl (2Z)-5-(2-ethoxy-3-methoxyphenyl)-7-methyl-2-(4-methylbenzylidene)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK103187
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)/c(=C/c1ccc(cc1)C)/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 C27H28N2O5S MW 492.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H28N2O5S/c1-6-33-24-19(9-8-10-20(24)32-5)23-22(26(31)34-7-2)17(4)28-27-29(23)25(30)21(35-27)15-18-13-11-16(3)12-14-18/h8-15,23H,6-7H2,1-5H3/b21-15-InChIKey
KCKJYEMYISIBIH-QNGOZBTKSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1cccc(c1OCC)OC)c(=O)c(=Cc1ccc(cc1)C)s2
CCOC1=C(C=CC=C1OC)C2C(=C(N=C3N2C(=O)C(=CC4=CC=C(C=C4)C)S3)C)C(=O)OCC
ETHYL(2Z)5(2ETHOXY3METHOXYPHENYL)7METHYL2((4METHYLPHENYL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)5(2ETHOXY3METHOXYPHENYL)7METHYL2(4METHYLBENZYLIDENE)3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H28N2O5Sc16332419(981020(24)325)2322(26(31)3472)17(4)282729(23)25(30)21(3527)1518131116(3)121418h81523H67H215H3b2115
MFCD03167895
ZINC000009305761
ZINC000009305763
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