Vitas-M small molecule compound
ethyl (2Z)-2-({5-[(2,3-dichlorophenoxy)methyl]furan-2-yl}methylidene)-7-methyl-3-oxo-5-phenyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL174226
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C/c1ccc(o1)COc1cccc(c1Cl)Cl)/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 C28H22Cl2N2O5S MW 569.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22Cl2N2O5S/c1-3-35-27(34)23-16(2)31-28-32(25(23)17-8-5-4-6-9-17)26(33)22(38-28)14-18-12-13-19(37-18)15-36-21-11-7-10-20(29)24(21)30/h4-14,25H,3,15H2,1-2H3/b22-14-InChIKey
RXKVITWQEHXDFB-HMAPJEAMSA-NSynonyms
445239-47-4445239474
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1ccc(o1)COc1cccc(c1Cl)Cl)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=CC=C(O4)COC5=C(C(=CC=C5)Cl)Cl)S2)C
ethyl(2Z)2((5((23dichlorophenoxy)methyl)furan2yl)methylidene)7methyl3oxo5phenyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((5((23DICHLOROPHENOXY)METHYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5PHENYL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2((5((23DICHLOROPHENOXY)METHYL)2FURYL)METHYLENE)7METHYL3OXO5PHENYL23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H22Cl2N2O5Sc133527(34)2316(2)312832(25(23)178546917)26(33)22(3828)1418121319(3718)1536211171020(29)24(21)30h41425H315H212H3b2214
MFCD02374314
ZINC000002108896
ZINC000002108902
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