Vitas-M small molecule compound
ethyl (2Z)-5-[4-(dimethylamino)phenyl]-7-methyl-3-oxo-2-[4-(prop-2-en-1-yloxy)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL296354
SMILES C=CCOc1ccc(cc1)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)N(C)C)C(=O)OCC)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 C28H29N3O4S MW 503.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O4S/c1-6-16-35-22-14-8-19(9-15-22)17-23-26(32)31-25(20-10-12-21(13-11-20)30(4)5)24(27(33)34-7-2)18(3)29-28(31)36-23/h6,8-15,17,25H,1,7,16H2,2-5H3/b23-17-InChIKey
QBNXPXDPEWFLRU-QJOMJCCJSA-NSynonyms
(Z)ethyl2(4(allyloxy)benzylidene)5(4(dimethylamino)phenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
C=CCOc1ccc(cc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)N(C)C)C(=O)OCC)C
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)N(C)C)C(=O)C(=CC4=CC=C(C=C4)OCC=C)S2)C
ethyl(2Z)5(4(dimethylamino)phenyl)7methyl3oxo2((4prop2enoxyphenyl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4(dimethylamino)phenyl)7methyl3oxo2(4(prop2en1yloxy)benzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4DIMETHYLAMINOPHENYL)7METHYL3OXO2((4PROP2ENOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL2(4(ALLYLOXY)BENZYLIDENE)5(4(DIMETHYLAMINO)PHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H29N3O4Sc1616352214819(91522)172326(32)3125(20101221(131120)30(4)5)24(27(33)3472)18(3)2928(31)3623h68151725H1716H225H3b2317
MFCD01592925
ZINC000002185095
ZINC000002185097
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