Vitas-M small molecule compound

3-[4-(3-chlorophenyl)piperazin-1-yl]-4-({[1-(dimethylamino)cyclohexyl]methyl}amino)cyclobut-3-ene-1,2-dione

Catalog ID
STL162799
SMILES Clc1cccc(c1)N1CCN(CC1)C1=C(C(=O)C1=O)NCC1(CCCCC1)N(C)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 C23H31ClN4O2 MW 430.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31ClN4O2/c1-26(2)23(9-4-3-5-10-23)16-25-19-20(22(30)21(19)29)28-13-11-27(12-14-28)18-8-6-7-17(24)15-18/h6-8,15,25H,3-5,9-14,16H2,1-2H3
InChIKey
DFPOCFWEMPUWFE-UHFFFAOYSA-N
Synonyms
1282102-86-6
1282102866
3(4(3chlorophenyl)piperazin1yl)4(((1(dimethylamino)cyclohexyl)methyl)amino)cyclobut3ene12dione
3(4(3chlorophenyl)piperazin1yl)4((1(dimethylamino)cyclohexyl)methylamino)cyclobut3ene12dione
CN(C)C1(CCCCC1)CNC2=C(C(=O)C2=O)N3CCN(CC3)C4=CC(=CC=C4)Cl
InChI=1SC23H31ClN4O2c126(2)23(94351023)16251920(22(30)21(19)29)28131127(121428)1886717(24)1518h681525H3591416H212H3
MFCD18799650
ZINC000101701501
ZINC101701501

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Available files

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