Vitas-M small molecule compound
3-(4-methylpiperazin-1-yl)-4-{[2-(4-methylpiperazin-1-yl)-2-phenylethyl]amino}cyclobut-3-ene-1,2-dione
Catalog ID
STL156913
SMILES CN1CCN(CC1)C1=C(C(=O)C1=O)NCC(c1ccccc1)N1CCN(CC1)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 C22H31N5O2 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31N5O2/c1-24-8-12-26(13-9-24)18(17-6-4-3-5-7-17)16-23-19-20(22(29)21(19)28)27-14-10-25(2)11-15-27/h3-7,18,23H,8-16H2,1-2H3InChIKey
LDULNDASTDJFQL-UHFFFAOYSA-NSynonyms
1246074-03-21246074032
3(4methylpiperazin1yl)4((2(4methylpiperazin1yl)2phenylethyl)amino)cyclobut3ene12dione
CN1CCN(CC1)C2=C(C(=O)C2=O)NCC(C3=CC=CC=C3)N4CCN(CC4)C
InChI=1SC22H31N5O2c12481226(13924)18(176435717)16231920(22(29)21(19)28)27141025(2)111527h371823H816H212H3
MFCD18069774
ZINC000101687148
ZINC000101687151
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