Vitas-M small molecule compound

prop-2-en-1-yl (2E)-2-[4-(diethylamino)benzylidene]-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK702932
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C\c1ccc(cc1)N(CC)CC)/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 C30H33N3O5S MW 547.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H33N3O5S/c1-7-16-38-29(35)26-19(4)31-30-33(27(26)21-12-15-23(36-5)24(18-21)37-6)28(34)25(39-30)17-20-10-13-22(14-11-20)32(8-2)9-3/h7,10-15,17-18,27H,1,8-9,16H2,2-6H3/b25-17+
InChIKey
WVLNCYTWNJODLY-KOEQRZSOSA-N
Synonyms
373620-08-7
(E)allyl2(4(diethylamino)benzylidene)5(34dimethoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
373620087
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccc(cc1)N(CC)CC)s2
CCN(CC)C1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC=C)C4=CC(=C(C=C4)OC)OC
InChI=1SC30H33N3O5Sc17163829(35)2619(4)313033(27(26)21121523(365)24(1821)376)28(34)25(3930)1720101322(141120)32(82)93h71015171827H18916H226H3b2517+
MFCD01949525
prop2en1yl(2E)2(4(diethylamino)benzylidene)5(34dimethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2E)2((4(DIETHYLAMINO)PHENYL)METHYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000100718596
ZINC000100718598

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Available files

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