N,N-diethyl-2-[4-[methylsulfonyl(phenyl)amino]butanoylamino]benzamide

Systemtic Name: N,N-diethyl-2-[4-[methylsulfonyl(phenyl)amino]butanoylamino]benzamide Openeye Name: N,N-diethyl-2-[4-(N-methylsulfonylanilino)butanoylamino]benzamide CAS Name: N,N-diethyl-2-[[4-(N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N,N-diethyl-2-[4-(N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: N,N-diethyl-2-[4-(N-mesylanilino)butanoylamino]benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=CC=C1NC(=O)CCCN(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O4S/c1-4-24(5-2)22(27)19-14-9-10-15-20(19)23-21(26)16-11-17-25(30(3,28)29)18-12-7-6-8-13-18/h6-10,12-15H,4-5,11,16-17H2,1-3H3,(H,23,26)