Vitas-M small molecule compound

N-(4-butylphenyl)-2-chloro-5-iodobenzamide

Catalog ID
STL412247
SMILES CCCCc1ccc(cc1)NC(=O)c1cc(I)ccc1Cl

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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 C17H17ClINO MW 413.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17ClINO/c1-2-3-4-12-5-8-14(9-6-12)20-17(21)15-11-13(19)7-10-16(15)18/h5-11H,2-4H2,1H3,(H,20,21)
InChIKey
MLDULQKVGGKSFT-UHFFFAOYSA-N
Synonyms

CCCCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)I)Cl
InChI=1SC17H17ClINOc1234125814(9612)2017(21)151113(19)71016(15)18h511H24H21H3(H2021)
MFCD02639740
N(4butylphenyl)2chloro5iodobenzamide
ZINC000002978804
ZINC02978804
ZINC2978804

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Available files

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