Vitas-M small molecule compound
2-[(4,6-dimethylpyrimidin-2-yl)amino]-4-(methylsulfanyl)-1-(4-phenylpiperazin-1-yl)butan-1-one
Catalog ID
STL317097
SMILES CSCCC(C(=O)N1CCN(CC1)c1ccccc1)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 C21H29N5OS MW 399.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H29N5OS/c1-16-15-17(2)23-21(22-16)24-19(9-14-28-3)20(27)26-12-10-25(11-13-26)18-7-5-4-6-8-18/h4-8,15,19H,9-14H2,1-3H3,(H,22,23,24)InChIKey
GWMSIYNHFRVBTM-UHFFFAOYSA-NSynonyms
1435898-47-71435898477
2((46dimethylpyrimidin2yl)amino)4(methylsulfanyl)1(4phenylpiperazin1yl)butan1one
2((46dimethylpyrimidin2yl)amino)4(methylthio)1(4phenylpiperazin1yl)butan1one
2((46dimethylpyrimidin2yl)amino)4methylsulfanyl1(4phenylpiperazin1yl)butan1one
CC1=CC(=NC(=N1)NC(CCSC)C(=O)N2CCN(CC2)C3=CC=CC=C3)C
InChI=1SC21H29N5OSc1161517(2)2321(2216)2419(914283)20(27)26121025(111326)187546818h481519H914H213H3(H222324)
MFCD23139299
ZINC000095478249
ZINC000095478250
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