2-azanyl-3-methyl-N-[1-phenyl-2-(phenylsulfonylamino)butan-2-yl]pentanamide

Systemtic Name: 2-azanyl-3-methyl-N-[1-phenyl-2-(phenylsulfonylamino)butan-2-yl]pentanamide Openeye Name: 2-amino-N-[1-(benzenesulfonamido)-1-benzyl-propyl]-3-methyl-pentanamide CAS Name: 2-amino-N-[2-(benzenesulfonamido)-1-phenylbutan-2-yl]-3-methylpentanamide IUPAC Name: 2-amino-N-[2-(benzenesulfonamido)-1-phenylbutan-2-yl]-3-methylpentanamide Traditional Name: 2-amino-N-[1-(benzenesulfonamido)-1-benzyl-propyl]-3-methyl-valeramide Formula: C22H31N3O3S MolecularWeight: 417.56484

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC)(CC1=CC=CC=C1)NS(=O)(=O)C2=CC=CC=C2)N

Isomeric SMILES

CCC(C)C(C(=O)NC(CC)(CC1=CC=CC=C1)NS(=O)(=O)C2=CC=CC=C2)N

InChI

InChI=1S/C22H31N3O3S/c1-4-17(3)20(23)21(26)24-22(5-2,16-18-12-8-6-9-13-18)25-29(27,28)19-14-10-7-11-15-19/h6-15,17,20,25H,4-5,16,23H2,1-3H3,(H,24,26)