Vitas-M small molecule compound
ethyl (2Z)-5-[4-(acetyloxy)-3-ethoxyphenyl]-7-methyl-3-oxo-2-(thiophen-2-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK533154
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)/c(=C/c1cccs1)/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 C25H24N2O6S2 MW 512.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O6S2/c1-5-31-19-12-16(9-10-18(19)33-15(4)28)22-21(24(30)32-6-2)14(3)26-25-27(22)23(29)20(35-25)13-17-8-7-11-34-17/h7-13,22H,5-6H2,1-4H3/b20-13-InChIKey
HHRWEAHRRYFBRN-MOSHPQCFSA-NSynonyms
(Z)ethyl5(4acetoxy3ethoxyphenyl)7methyl3oxo2(thiophen2ylmethylene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OC(=O)C)c(=O)c(=Cc1cccs1)s2
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC=CS4)S3)C)C(=O)OCC)OC(=O)C
ethyl(2Z)5(4(acetyloxy)3ethoxyphenyl)7methyl3oxo2(thiophen2ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ACETYLOXY3ETHOXYPHENYL)7METHYL3OXO2(THIOPHEN2YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC25H24N2O6S2c1531191216(91018(19)3315(4)28)2221(24(30)3262)14(3)262527(22)23(29)20(3525)131787113417h71322H56H214H3b2013
MFCD01958304
ZINC000002287474
ZINC000002287476
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