Vitas-M small molecule compound

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

Catalog ID
STK861366
SMILES CCN(c1ccc(cc1)/C=c\1/sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OC)C)CC

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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 C27H29N3O4S MW 491.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N3O4S/c1-6-29(7-2)20-12-8-18(9-13-20)16-22-25(31)30-24(19-10-14-21(33-4)15-11-19)23(26(32)34-5)17(3)28-27(30)35-22/h8-16,24H,6-7H2,1-5H3/b22-16+
InChIKey
DDZXGHMLQMIUTD-CJLVFECKSA-N
Synonyms
324543-12-6
(E)methyl2(4(diethylamino)benzylidene)5(4methoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
324543126
CCN(c1ccc(cc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)OC)C(=O)OC)C)CC
CCN(CC)C1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)OC
InChI=1SC27H29N3O4Sc1629(72)2012818(91320)162225(31)3024(19101421(334)151119)23(26(32)345)17(3)2827(30)3522h81624H67H215H3b2216+
METHYL(2E)2((4(DIETHYLAMINO)PHENYL)METHYLIDENE)5(4METHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
methyl(2E)2(4(diethylamino)benzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01458312
ZINC000001221209
ZINC000013774892

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.