Vitas-M small molecule compound
(2E)-2-{4-[(2-cyanobenzyl)oxy]benzylidene}-5-(3,4-dimethoxyphenyl)-7-methyl-N-(2-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxamide
Catalog ID
STL438404
SMILES COc1cc(ccc1OC)C1C(=C(C)N=c2n1c(=O)/c(=C\c1ccc(cc1)OCc1ccccc1C#N)/s2)C(=O)Nc1ccccc1C
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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 C38H32N4O5S MW 656.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C38H32N4O5S/c1-23-9-5-8-12-30(23)41-36(43)34-24(2)40-38-42(35(34)26-15-18-31(45-3)32(20-26)46-4)37(44)33(48-38)19-25-13-16-29(17-14-25)47-22-28-11-7-6-10-27(28)21-39/h5-20,35H,22H2,1-4H3,(H,41,43)/b33-19+InChIKey
ONGVTTDOFMMHAG-HNSNBQBZSA-NSynonyms
(2E)2((4((2cyanophenyl)methoxy)phenyl)methylidene)5(34dimethoxyphenyl)7methylN(2methylphenyl)3oxo5H(13)thiazolo(32a)pyrimidine6carboxamide
(2E)2(4((2cyanobenzyl)oxy)benzylidene)5(34dimethoxyphenyl)7methylN(2methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxamide
CC1=CC=CC=C1NC(=O)C2=C(N=C3N(C2C4=CC(=C(C=C4)OC)OC)C(=O)C(=CC5=CC=C(C=C5)OCC6=CC=CC=C6C#N)S3)C
COc1cc(ccc1OC)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccc(cc1)OCc1ccccc1C#N)s2)C(=O)Nc1ccccc1C
InChI=1SC38H32N4O5Sc1239581230(23)4136(43)3424(2)403842(35(34)26151831(453)32(2026)464)37(44)33(4838)1925131629(171425)47222811761027(28)2139h52035H22H214H3(H4143)b3319+
MFCD06242103
ZINC000150345162
ZINC000150345164
Check stock
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Check stock on Vitas-MAvailable files
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