Vitas-M small molecule compound
methyl (2E)-2-(3-bromobenzylidene)-7-methyl-3-oxo-5-[(E)-2-phenylethenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK044986
SMILES COC(=O)C1=C(C)N=c2n(C1/C=C/c1ccccc1)c(=O)/c(=C\c1cccc(c1)Br)/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 C24H19BrN2O3S MW 495.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19BrN2O3S/c1-15-21(23(29)30-2)19(12-11-16-7-4-3-5-8-16)27-22(28)20(31-24(27)26-15)14-17-9-6-10-18(25)13-17/h3-14,19H,1-2H3/b12-11+,20-14+InChIKey
POWVNXBPHXMMSH-IZOCETQSSA-NSynonyms
(Z)methyl2(3bromobenzylidene)7methyl3oxo5((E)styryl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC(=CC=C3)Br)SC2=N1)C=CC4=CC=CC=C4)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1C=Cc1ccccc1)c(=O)c(=Cc1cccc(c1)Br)s2
InChI=1SC24H19BrN2O3Sc11521(23(29)302)19(1211167435816)2722(28)20(3124(27)2615)1417961018(25)1317h31419H12H3b1211+2014+
methyl(2E)2((3bromophenyl)methylidene)7methyl3oxo5((E)2phenylethenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2E)2(3BROMOBENZYLIDENE)7METHYL3OXO5((E)2PHENYLETHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL5((1E)2PHENYLVINYL)2((3BROMOPHENYL)METHYLENE)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01033902
STK044986
ZINC000009425713
ZINC000009425714
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