N-ethyl-3-[[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]benzamide

Systemtic Name: N-ethyl-3-[[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]benzamide Openeye Name: N-ethyl-3-[[(2S)-4-methyl-2-(p-tolylsulfonylamino)pentanoyl]amino]benzamide CAS Name: N-ethyl-3-[[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]-1-oxopentyl]amino]benzamide IUPAC Name: N-ethyl-3-[[(2S)-4-methyl-2-[(4-methylphenyl)sulfonylamino]pentanoyl]amino]benzamide Traditional Name: N-ethyl-3-[[(2S)-4-methyl-2-(tosylamino)pentanoyl]amino]benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S/c1-5-23-21(26)17-7-6-8-18(14-17)24-22(27)20(13-15(2)3)25-30(28,29)19-11-9-16(4)10-12-19/h6-12,14-15,20,25H,5,13H2,1-4H3,(H,23,26)(H,24,27)/t20-/m0/s1