Vitas-M small molecule compound
2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(methylsulfanyl)-1-[4-(pyridin-2-yl)piperazin-1-yl]butan-1-one
Catalog ID
STL308893
SMILES CSCCC(C(=O)N1CCN(CC1)c1ccccn1)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 C20H28N6OS MW 400.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N6OS/c1-15-14-16(2)23-20(22-15)24-17(7-13-28-3)19(27)26-11-9-25(10-12-26)18-6-4-5-8-21-18/h4-6,8,14,17H,7,9-13H2,1-3H3,(H,22,23,24)InChIKey
SPHWVTVPOJCPIE-UHFFFAOYSA-NSynonyms
1435905-04-61435905046
2((46dimethylpyrimidin2yl)amino)4(methylsulfanyl)1(4(pyridin2yl)piperazin1yl)butan1one
2((46dimethylpyrimidin2yl)amino)4(methylthio)1(4(pyridin2yl)piperazin1yl)butan1one
2((46dimethylpyrimidin2yl)amino)4methylsulfanyl1(4pyridin2ylpiperazin1yl)butan1one
CC1=CC(=NC(=N1)NC(CCSC)C(=O)N2CCN(CC2)C3=CC=CC=N3)C
InChI=1SC20H28N6OSc1151416(2)2320(2215)2417(713283)19(27)2611925(101226)1864582118h4681417H7913H213H3(H222324)
MFCD23139224
ZINC000095472176
ZINC000095472177
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