2-azanyl-3-(4-chlorophenyl)-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]propanamide

Systemtic Name: 2-azanyl-3-(4-chlorophenyl)-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]propanamide Openeye Name: 2-amino-N-[(1S)-1-benzyl-3-(4-pyridylamino)propyl]-3-(4-chlorophenyl)propanamide CAS Name: 2-amino-3-(4-chlorophenyl)-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]propanamide IUPAC Name: 2-amino-3-(4-chlorophenyl)-N-[(2S)-1-phenyl-4-(pyridin-4-ylamino)butan-2-yl]propanamide Traditional Name: 2-amino-N-[(1S)-1-benzyl-3-(4-pyridylamino)propyl]-3-(4-chlorophenyl)propionamide Formula: C24H27ClN4O MolecularWeight: 422.95038

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27ClN4O/c25-20-8-6-19(7-9-20)17-23(26)24(30)29-22(16-18-4-2-1-3-5-18)12-15-28-21-10-13-27-14-11-21/h1-11,13-14,22-23H,12,15-17,26H2,(H,27,28)(H,29,30)/t22-,23?/m1/s1