Vitas-M small molecule compound

N-[(1Z)-1-(2-chloro-7-methoxyquinolin-3-yl)-3-oxo-3-(propan-2-ylamino)prop-1-en-2-yl]benzamide

Catalog ID
STK731229
SMILES COc1ccc2c(c1)nc(c(c2)/C=C(/C(=O)NC(C)C)\NC(=O)c1ccccc1)Cl

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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 C23H22ClN3O3 MW 423.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3/c1-14(2)25-23(29)20(27-22(28)15-7-5-4-6-8-15)12-17-11-16-9-10-18(30-3)13-19(16)26-21(17)24/h4-14H,1-3H3,(H,25,29)(H,27,28)/b20-12-
InChIKey
VUNRYWSHTYBHLZ-NDENLUEZSA-N
Synonyms
902008-88-2
(Z)N(1(2chloro7methoxyquinolin3yl)3(isopropylamino)3oxoprop1en2yl)benzamide
902008882
CC(C)NC(=O)C(=CC1=C(N=C2C=C(C=CC2=C1)OC)Cl)NC(=O)C3=CC=CC=C3
COc1ccc2c(c1)nc(c(c2)C=C(C(=O)NC(C)C)NC(=O)c1ccccc1)Cl
InChI=1SC23H22ClN3O3c114(2)2523(29)20(2722(28)157546815)1217111691018(303)1319(16)2621(17)24h414H13H3(H2529)(H2728)b2012
MFCD06787483
N((1Z)1(2chloro7methoxyquinolin3yl)3oxo3(propan2ylamino)prop1en2yl)benzamide
N((Z)1(2chloro7methoxyquinolin3yl)3oxo3(propan2ylamino)prop1en2yl)benzamide
ZINC000009302811
ZINC09302811
ZINC9302811

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Available files

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