Vitas-M small molecule compound
(4E)-2-(4-chlorophenyl)-4-({[3-(1H-imidazol-1-yl)propyl]amino}methylidene)isoquinoline-1,3(2H,4H)-dione
Catalog ID
STK628281
SMILES Clc1ccc(cc1)N1C(=O)/C(=C/NCCCn2cncc2)/c2c(C1=O)cccc2
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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 C22H19ClN4O2 MW 406.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClN4O2/c23-16-6-8-17(9-7-16)27-21(28)19-5-2-1-4-18(19)20(22(27)29)14-24-10-3-12-26-13-11-25-15-26/h1-2,4-9,11,13-15,24H,3,10,12H2/b20-14+InChIKey
OEQNLMHMCKPTIC-XSFVSMFZSA-NSynonyms
(4E)2(4chlorophenyl)4(((3(1Himidazol1yl)propyl)amino)methylidene)isoquinoline13(2H4H)dione
(4E)2(4chlorophenyl)4((3imidazol1ylpropylamino)methylidene)isoquinoline13dione
(E)4(((3(1Himidazol1yl)propyl)amino)methylene)2(4chlorophenyl)isoquinoline13(2H4H)dione
C1=CC=C2C(=C1)C(=CNCCCN3C=CN=C3)C(=O)N(C2=O)C4=CC=C(C=C4)Cl
Clc1ccc(cc1)N1C(=O)C(=CNCCCn2cncc2)c2c(C1=O)cccc2
InChI=1SC22H19ClN4O2c23166817(9716)2721(28)19521418(19)20(22(27)29)142410312261311251526h124911131524H31012H2b2014+
MFCD09858209
ZINC000020675571
ZINC20675571
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