Vitas-M small molecule compound

methyl 3-(butanoylamino)-4-(4-ethylpiperazin-1-yl)benzoate

Catalog ID
STK189084
SMILES CCCC(=O)Nc1cc(ccc1N1CCN(CC1)CC)C(=O)OC

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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 C18H27N3O3 MW 333.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O3/c1-4-6-17(22)19-15-13-14(18(23)24-3)7-8-16(15)21-11-9-20(5-2)10-12-21/h7-8,13H,4-6,9-12H2,1-3H3,(H,19,22)
InChIKey
OTFNSHBFBIYXIN-UHFFFAOYSA-N
Synonyms

CCCC(=O)NC1=C(C=CC(=C1)C(=O)OC)N2CCN(CC2)CC
InChI=1SC18H27N3O3c14617(22)19151314(18(23)243)7816(15)2111920(52)101221h7813H46912H213H3(H1922)
METHYL3(BUTANOYLAMINO)4(4ETHYLPIPERAZIN1YL)BENZOATE
MFCD06665170
ZINC000004711672
ZINC4711672

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Available files

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