Vitas-M small molecule compound
2-[(4-acetylpiperazin-1-yl)methyl]-4-{[2-(methoxycarbonyl)thiophen-3-yl]amino}-4-oxobutanoic acid
Catalog ID
STL151966
SMILES COC(=O)c1sccc1NC(=O)CC(C(=O)O)CN1CCN(CC1)C(=O)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 C17H23N3O6S MW 397.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H23N3O6S/c1-11(21)20-6-4-19(5-7-20)10-12(16(23)24)9-14(22)18-13-3-8-27-15(13)17(25)26-2/h3,8,12H,4-7,9-10H2,1-2H3,(H,18,22)(H,23,24)InChIKey
JMBYNCTVQBVYKX-UHFFFAOYSA-NSynonyms
1282116-97-51282116975
2((4acetylpiperazin1yl)methyl)4((2(methoxycarbonyl)thiophen3yl)amino)4oxobutanoicacid
2((4acetylpiperazin1yl)methyl)4((2methoxycarbonylthiophen3yl)amino)4oxobutanoicacid
CC(=O)N1CCN(CC1)CC(CC(=O)NC2=C(SC=C2)C(=O)OC)C(=O)O
InChI=1SC17H23N3O6Sc111(21)206419(5720)1012(16(23)24)914(22)1813382715(13)17(25)262h3812H47910H212H3(H1822)(H2324)
MFCD18799994
ZINC000061721701
ZINC000061721702
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