N-(2,6-diethylphenyl)-4-[methylsulfonyl(phenyl)amino]butanamide

Systemtic Name: N-(2,6-diethylphenyl)-4-[methylsulfonyl(phenyl)amino]butanamide Openeye Name: N-(2,6-diethylphenyl)-4-(N-methylsulfonylanilino)butanamide CAS Name: N-(2,6-diethylphenyl)-4-(N-methylsulfonylanilino)butanamide IUPAC Name: N-(2,6-diethylphenyl)-4-(N-methylsulfonylanilino)butanamide Traditional Name: N-(2,6-diethylphenyl)-4-(N-mesylanilino)butyramide Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C21H28N2O3S/c1-4-17-11-9-12-18(5-2)21(17)22-20(24)15-10-16-23(27(3,25)26)19-13-7-6-8-14-19/h6-9,11-14H,4-5,10,15-16H2,1-3H3,(H,22,24)