Vitas-M small molecule compound
propan-2-yl (2E)-7-methyl-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797849
SMILES CC(OC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C\C=C\c1ccccc1)/s2)C
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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 C24H22N2O3S2 MW 450.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22N2O3S2/c1-15(2)29-23(28)20-16(3)25-24-26(21(20)18-13-8-14-30-18)22(27)19(31-24)12-7-11-17-9-5-4-6-10-17/h4-15,21H,1-3H3/b11-7+,19-12+InChIKey
COOWPSPYNUGPMU-FMFDFCGUSA-NSynonyms
CC(OC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=CC=Cc1ccccc1)s2)C
CC1=C(C(N2C(=O)C(=CC=CC3=CC=CC=C3)SC2=N1)C4=CC=CS4)C(=O)OC(C)C
InChI=1SC24H22N2O3S2c115(2)2923(28)2016(3)252426(21(20)18138143018)22(27)19(3124)127111795461017h41521H13H3b117+1912+
MFCD03461775
propan2yl(2E)7methyl3oxo2((2E)3phenylprop2en1ylidene)5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROPAN2YL(2E)7METHYL3OXO2((E)3PHENYLPROP2ENYLIDENE)5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000016700010
ZINC000016700012
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