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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)N(CC)CC)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)N(CC)CC)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O4S/c1-5-20(25(30(4,28)29)17-13-9-8-10-14-17)21(26)23-19-16-12-11-15-18(19)22(27)24(6-2)7-3/h8-16,20H,5-7H2,1-4H3,(H,23,26)