Vitas-M small molecule compound
propan-2-yl (2E)-5-(4-methoxyphenyl)-7-methyl-3-oxo-2-(4-propoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797802
SMILES CCCOc1ccc(cc1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OC(C)C)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 C28H30N2O5S MW 506.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H30N2O5S/c1-6-15-34-22-11-7-19(8-12-22)16-23-26(31)30-25(20-9-13-21(33-5)14-10-20)24(27(32)35-17(2)3)18(4)29-28(30)36-23/h7-14,16-17,25H,6,15H2,1-5H3/b23-16+InChIKey
KVPVJGHDFPBLQB-XQNSMLJCSA-NSynonyms
CCCOC1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC(C)C)C4=CC=C(C=C4)OC
CCCOc1ccc(cc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OC(C)C)C
InChI=1SC28H30N2O5Sc1615342211719(81222)162326(31)3025(2091321(335)141020)24(27(32)3517(2)3)18(4)2928(30)3623h714161725H615H215H3b2316+
MFCD03417170
PROPAN2YL(2E)5(4METHOXYPHENYL)7METHYL3OXO2((4PROPOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
propan2yl(2E)5(4methoxyphenyl)7methyl3oxo2(4propoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000016699904
ZINC000016699906
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