Vitas-M small molecule compound
methyl (2Z)-2-[4-(methoxycarbonyl)benzylidene]-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK794248
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc(cc1)C(=O)OC)/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 C27H26N2O5S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5S/c1-15(2)18-10-12-19(13-11-18)23-22(26(32)34-5)16(3)28-27-29(23)24(30)21(35-27)14-17-6-8-20(9-7-17)25(31)33-4/h6-15,23H,1-5H3/b21-14-InChIKey
LCOLREGGAXYJLO-STZFKDTASA-NSynonyms
(E)methyl5(4isopropylphenyl)2(4(methoxycarbonyl)benzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)SC2=N1)C4=CC=C(C=C4)C(C)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)c(=Cc1ccc(cc1)C(=O)OC)s2
InChI=1SC27H26N2O5Sc115(2)18101219(131118)2322(26(32)345)16(3)282729(23)24(30)21(3527)14176820(9717)25(31)334h61523H15H3b2114
METHYL(2Z)2((4METHOXYCARBONYLPHENYL)METHYLIDENE)7METHYL3OXO5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2Z)2(4(methoxycarbonyl)benzylidene)7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD13372474
ZINC000002276824
ZINC000002276826
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