Vitas-M small molecule compound
2-[(4,6-dimethylpyrimidin-2-yl)amino]-1-[4-(1H-indol-3-yl)-3,6-dihydropyridin-1(2H)-yl]-4-(methylsulfanyl)butan-1-one
Catalog ID
STL318014
SMILES CSCCC(C(=O)N1CCC(=CC1)c1c[nH]c2c1cccc2)Nc1nc(C)cc(n1)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 C24H29N5OS MW 435.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H29N5OS/c1-16-14-17(2)27-24(26-16)28-22(10-13-31-3)23(30)29-11-8-18(9-12-29)20-15-25-21-7-5-4-6-19(20)21/h4-8,14-15,22,25H,9-13H2,1-3H3,(H,26,27,28)InChIKey
GKCICBIRNOEENO-UHFFFAOYSA-NSynonyms
1435905-88-61(4(1Hindol3yl)56dihydropyridin1(2H)yl)2((46dimethylpyrimidin2yl)amino)4(methylthio)butan1one
1435905886
2((46dimethylpyrimidin2yl)amino)1(4(1Hindol3yl)36dihydro2Hpyridin1yl)4methylsulfanylbutan1one
2((46dimethylpyrimidin2yl)amino)1(4(1Hindol3yl)36dihydropyridin1(2H)yl)4(methylsulfanyl)butan1one
CC1=CC(=NC(=N1)NC(CCSC)C(=O)N2CCC(=CC2)C3=CNC4=CC=CC=C43)C
CSCCC(C(=O)N1CCC(=CC1)c1c(nH)c2c1cccc2)Nc1nc(C)cc(n1)C
InChI=1SC24H29N5OSc1161417(2)2724(2616)2822(1013313)23(30)2911818(91229)20152521754619(20)21h4814152225H913H213H3(H262728)
MFCD23139109
ZINC000095478970
ZINC000095478971
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