Vitas-M small molecule compound

3-(benzylamino)-4-(4-methylpiperazin-1-yl)cyclobut-3-ene-1,2-dione

Catalog ID
STK928222
SMILES CN1CCN(CC1)C1=C(C(=O)C1=O)NCc1ccccc1

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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 C16H19N3O2 MW 285.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H19N3O2/c1-18-7-9-19(10-8-18)14-13(15(20)16(14)21)17-11-12-5-3-2-4-6-12/h2-6,17H,7-11H2,1H3
InChIKey
GELYBGSWXWRSRR-UHFFFAOYSA-N
Synonyms
1224167-78-5
1224167785
3(benzylamino)4(4methylpiperazin1yl)cyclobut3ene12dione
CN1CCN(CC1)C2=C(C(=O)C2=O)NCC3=CC=CC=C3
InChI=1SC16H19N3O2c1187919(10818)1413(15(20)16(14)21)1711125324612h2617H711H21H3
MFCD18067741
ZINC000101681460
ZINC101681460

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.