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

Systemtic Name: N,N-diethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]benzamide Openeye Name: N,N-diethyl-3-[[(2S)-3-methyl-2-(p-tolylsulfonylamino)butanoyl]amino]benzamide CAS Name: N,N-diethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxobutyl]amino]benzamide IUPAC Name: N,N-diethyl-3-[[(2S)-3-methyl-2-[(4-methylphenyl)sulfonylamino]butanoyl]amino]benzamide Traditional Name: N,N-diethyl-3-[[(2S)-3-methyl-2-(tosylamino)butanoyl]amino]benzamide Formula: C23H31N3O4S MolecularWeight: 445.57494

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C23H31N3O4S/c1-6-26(7-2)23(28)18-9-8-10-19(15-18)24-22(27)21(16(3)4)25-31(29,30)20-13-11-17(5)12-14-20/h8-16,21,25H,6-7H2,1-5H3,(H,24,27)/t21-/m0/s1