Vitas-M small molecule compound
2-{(2E)-2-[4-(dimethylamino)benzylidene]hydrazinyl}-6,6-dimethyl-3-(4-methylphenyl)-3,5,6,8-tetrahydro-4H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STL296636
SMILES Cc1ccc(cc1)n1c(N/N=C/c2ccc(cc2)N(C)C)nc2c(c1=O)c1CC(C)(C)OCc1s2
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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 C27H29N5O2S MW 487.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29N5O2S/c1-17-6-10-20(11-7-17)32-25(33)23-21-14-27(2,3)34-16-22(21)35-24(23)29-26(32)30-28-15-18-8-12-19(13-9-18)31(4)5/h6-13,15H,14,16H2,1-5H3,(H,29,30)/b28-15+InChIKey
CKTMMZCKBJOKRF-RWPZCVJISA-NSynonyms
(E)2(2(4(dimethylamino)benzylidene)hydrazinyl)66dimethyl3(ptolyl)56dihydro3Hpyrano(4345)thieno(23d)pyrimidin4(8H)one
2((2E)2((4(dimethylamino)phenyl)methylidene)hydrazinyl)66dimethyl3(4methylphenyl)58dihydropyrano(23)thieno(24b)pyrimidin4one
2((2E)2(4(dimethylamino)benzylidene)hydrazinyl)66dimethyl3(4methylphenyl)3568tetrahydro4Hpyrano(4345)thieno(23d)pyrimidin4one
CC1=CC=C(C=C1)N2C(=O)C3=C(N=C2NN=CC4=CC=C(C=C4)N(C)C)SC5=C3CC(OC5)(C)C
Cc1ccc(cc1)n1c(NN=Cc2ccc(cc2)N(C)C)nc2c(c1=O)c1CC(C)(C)OCc1s2
InChI=1SC27H29N5O2Sc11761020(11717)3225(33)23211427(23)341622(21)3524(23)2926(32)3028151881219(13918)31(4)5h61315H1416H215H3(H2930)b2815+
MFCD01875483
ZINC000009144772
ZINC39949551
Check stock
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Check stock on Vitas-MAvailable files
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