Vitas-M small molecule compound

dimethyl 5-{[4-methoxy-2-(4-methylpiperazin-1-yl)-4-oxobutanoyl]amino}benzene-1,3-dicarboxylate

Catalog ID
STL070950
SMILES COC(=O)CC(C(=O)Nc1cc(cc(c1)C(=O)OC)C(=O)OC)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 C20H27N3O7 MW 421.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27N3O7/c1-22-5-7-23(8-6-22)16(12-17(24)28-2)18(25)21-15-10-13(19(26)29-3)9-14(11-15)20(27)30-4/h9-11,16H,5-8,12H2,1-4H3,(H,21,25)
InChIKey
IXHNRDLPUQNHKD-UHFFFAOYSA-N
Synonyms
709003-28-1
709003281
CN1CCN(CC1)C(CC(=O)OC)C(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC
DIMETHYL5((4METHOXY2(4METHYL1PIPERAZINYL)4OXOBUTANOYL)AMINO)ISOPHTHALATE
dimethyl5((4methoxy2(4methylpiperazin1yl)4oxobutanoyl)amino)benzene13dicarboxylate
dimethyl5(4methoxy2(4methylpiperazin1yl)4oxobutanamido)isophthalate
InChI=1SC20H27N3O7c1225723(8622)16(1217(24)282)18(25)21151013(19(26)293)914(1115)20(27)304h91116H5812H214H3(H2125)
MFCD04156928
ZINC000020357861
ZINC000020357863

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Available files

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