(2S)-2-[(4-methylphenyl)sulfonylamino]-N-[[3-[[[(2S)-2-[(4-methylphenyl)sulfonylamino]propanoyl]amino]methyl]phenyl]methyl]propanamide

Systemtic Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-N-[[3-[[[(2S)-2-[(4-methylphenyl)sulfonylamino]propanoyl]amino]methyl]phenyl]methyl]propanamide Openeye Name: (2S)-2-(p-tolylsulfonylamino)-N-[[3-[[[(2S)-2-(p-tolylsulfonylamino)propanoyl]amino]methyl]phenyl]methyl]propanamide CAS Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-N-[[3-[[[(2S)-2-[(4-methylphenyl)sulfonylamino]-1-oxopropyl]amino]methyl]phenyl]methyl]propanamide IUPAC Name: (2S)-2-[(4-methylphenyl)sulfonylamino]-N-[[3-[[[(2S)-2-[(4-methylphenyl)sulfonylamino]propanoyl]amino]methyl]phenyl]methyl]propanamide Traditional Name: (2S)-2-(tosylamino)-N-[3-[[[(2S)-2-(tosylamino)propanoyl]amino]methyl]benzyl]propionamide Formula: C28H34N4O6S2 MolecularWeight: 586.72276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NCC2=CC(=CC=C2)CNC(=O)C(C)NS(=O)(=O)C3=CC=C(C=C3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N[C@@H](C)C(=O)NCC2=CC(=CC=C2)CNC(=O)[C@H](C)NS(=O)(=O)C3=CC=C(C=C3)C

InChI

InChI=1S/C28H34N4O6S2/c1-19-8-12-25(13-9-19)39(35,36)31-21(3)27(33)29-17-23-6-5-7-24(16-23)18-30-28(34)22(4)32-40(37,38)26-14-10-20(2)11-15-26/h5-16,21-22,31-32H,17-18H2,1-4H3,(H,29,33)(H,30,34)/t21-,22-/m0/s1