N-methyl-3-[[[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]methyl]benzamide

Systemtic Name: N-methyl-3-[[[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]methyl]benzamide Openeye Name: N-methyl-3-[[[3-methyl-2-(p-tolylsulfonylamino)butanoyl]amino]methyl]benzamide CAS Name: N-methyl-3-[[[3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]amino]methyl]benzamide IUPAC Name: N-methyl-3-[[[3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]methyl]benzamide Traditional Name: N-methyl-3-[[[3-methyl-2-(tosylamino)butanoyl]amino]methyl]benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCC2=CC=CC(=C2)C(=O)NC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C(C)C)C(=O)NCC2=CC=CC(=C2)C(=O)NC

InChI

InChI=1S/C21H27N3O4S/c1-14(2)19(24-29(27,28)18-10-8-15(3)9-11-18)21(26)23-13-16-6-5-7-17(12-16)20(25)22-4/h5-12,14,19,24H,13H2,1-4H3,(H,22,25)(H,23,26)