Vitas-M small molecule compound
methyl (2E)-7-methyl-2-(4-methylbenzylidene)-3-oxo-5-[(E)-2-phenylethenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK876949
SMILES COC(=O)C1=C(C)N=c2n(C1/C=C/c1ccccc1)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 C25H22N2O3S MW 430.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O3S/c1-16-9-11-19(12-10-16)15-21-23(28)27-20(14-13-18-7-5-4-6-8-18)22(24(29)30-3)17(2)26-25(27)31-21/h4-15,20H,1-3H3/b14-13+,21-15+InChIKey
LCQDLRBIVGVMSK-KMMVFWCYSA-NSynonyms
321976-39-0(E)methyl7methyl2(4methylbenzylidene)3oxo5((E)styryl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
321976390
CC1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C=CC4=CC=CC=C4
COC(=O)C1=C(C)N=c2n(C1C=Cc1ccccc1)c(=O)c(=Cc1ccc(cc1)C)s2
InChI=1SC25H22N2O3Sc11691119(121016)152123(28)2720(1413187546818)22(24(29)303)17(2)2625(27)3121h41520H13H3b1413+2115+
METHYL(2E)7METHYL2((4METHYLPHENYL)METHYLIDENE)3OXO5((E)2PHENYLETHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2E)7methyl2(4methylbenzylidene)3oxo5((E)2phenylethenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL5((1E)2PHENYLVINYL)7METHYL2((4METHYLPHENYL)METHYLENE)3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
MFCD00718508
ZINC000008915402
ZINC000013563670
Check stock
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Check stock on Vitas-MAvailable files
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