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

Systemtic Name: 2-[2-[methylsulfonyl(phenyl)amino]butanoylamino]-N-propyl-benzamide Openeye Name: 2-[2-(N-methylsulfonylanilino)butanoylamino]-N-propyl-benzamide CAS Name: 2-[[2-(N-methylsulfonylanilino)-1-oxobutyl]amino]-N-propylbenzamide IUPAC Name: 2-[2-(N-methylsulfonylanilino)butanoylamino]-N-propylbenzamide Traditional Name: 2-[2-(N-mesylanilino)butanoylamino]-N-propyl-benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)C(CC)N(C2=CC=CC=C2)S(=O)(=O)C

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)C(CC)N(C2=CC=CC=C2)S(=O)(=O)C

InChI

InChI=1S/C21H27N3O4S/c1-4-15-22-20(25)17-13-9-10-14-18(17)23-21(26)19(5-2)24(29(3,27)28)16-11-7-6-8-12-16/h6-14,19H,4-5,15H2,1-3H3,(H,22,25)(H,23,26)