2-[(4-chlorophenyl)methylsulfonylamino]-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)methylsulfonylamino]-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]ethanamide Openeye Name: N-[(1S)-1-benzyl-3-(4-pyridylamino)propyl]-2-[(4-chlorophenyl)methylsulfonylamino]acetamide CAS Name: 2-[(4-chlorophenyl)methylsulfonylamino]-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]acetamide IUPAC Name: 2-[(4-chlorophenyl)methylsulfonylamino]-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]acetamide Traditional Name: N-[(1S)-1-benzyl-3-(4-pyridylamino)propyl]-2-[(4-chlorobenzyl)sulfonylamino]acetamide Formula: C24H27ClN4O3S MolecularWeight: 487.01418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CCNC2=CC=NC=C2)NC(=O)CNS(=O)(=O)CC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](CCNC2=CC=NC=C2)NC(=O)CNS(=O)(=O)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H27ClN4O3S/c25-21-8-6-20(7-9-21)18-33(31,32)28-17-24(30)29-23(16-19-4-2-1-3-5-19)12-15-27-22-10-13-26-14-11-22/h1-11,13-14,23,28H,12,15-18H2,(H,26,27)(H,29,30)/t23-/m1/s1