N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-3-ethyl-azetidine-3-carboxamide

Systemtic Name: N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-3-ethyl-azetidine-3-carboxamide Openeye Name: N-[(1S,2S)-3-(4-chlorophenyl)-2-(3-cyanophenyl)-1-methyl-propyl]-3-ethyl-azetidine-3-carboxamide CAS Name: N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-3-ethyl-3-azetidinecarboxamide IUPAC Name: N-[(2S,3S)-4-(4-chlorophenyl)-3-(3-cyanophenyl)butan-2-yl]-3-ethylazetidine-3-carboxamide Traditional Name: N-[(1S,2S)-3-(4-chlorophenyl)-2-(3-cyanophenyl)-1-methyl-propyl]-3-ethyl-azetidine-3-carboxamide Formula: C23H26ClN3O MolecularWeight: 395.92504

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CNC1)C(=O)NC(C)C(CC2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C#N

Isomeric SMILES

CCC1(CNC1)C(=O)N[C@@H](C)[C@@H](CC2=CC=C(C=C2)Cl)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C23H26ClN3O/c1-3-23(14-26-15-23)22(28)27-16(2)21(12-17-7-9-20(24)10-8-17)19-6-4-5-18(11-19)13-25/h4-11,16,21,26H,3,12,14-15H2,1-2H3,(H,27,28)/t16-,21+/m0/s1