Vitas-M small molecule compound

N-(1-{[4-(acetylamino)phenyl]amino}-3-methyl-1-oxobutan-2-yl)-4-methylcyclohexanecarboxamide

Catalog ID
STK248823
SMILES CC1CCC(CC1)C(=O)NC(C(=O)Nc1ccc(cc1)NC(=O)C)C(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 C21H31N3O3 MW 373.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H31N3O3/c1-13(2)19(24-20(26)16-7-5-14(3)6-8-16)21(27)23-18-11-9-17(10-12-18)22-15(4)25/h9-14,16,19H,5-8H2,1-4H3,(H,22,25)(H,23,27)(H,24,26)
InChIKey
BELKNGJWBKIDDS-UHFFFAOYSA-N
Synonyms

CC1CCC(CC1)C(=O)NC(C(C)C)C(=O)NC2=CC=C(C=C2)NC(=O)C
InChI=1SC21H31N3O3c113(2)19(2420(26)167514(3)6816)21(27)231811917(101218)2215(4)25h9141619H58H214H3(H2225)(H2327)(H2426)
MFCD08685586
N(1((4(acetylamino)phenyl)amino)3methyl1oxobutan2yl)4methylcyclohexanecarboxamide
N(1(4acetamidoanilino)3methyl1oxobutan2yl)4methylcyclohexane1carboxamide
ZINC000003895689
ZINC000003895690

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Available files

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