(2S,3R)-N-butyl-3-(4-chlorophenyl)-4-(4-methylphenyl)-2,3-dihydroazete-2-carboxamide

Systemtic Name: (2S,3R)-N-butyl-3-(4-chlorophenyl)-4-(4-methylphenyl)-2,3-dihydroazete-2-carboxamide Openeye Name: (2S,3R)-N-butyl-3-(4-chlorophenyl)-4-(p-tolyl)-2,3-dihydroazete-2-carboxamide CAS Name: (2S,3R)-N-butyl-3-(4-chlorophenyl)-4-(4-methylphenyl)-2,3-dihydroazete-2-carboxamide IUPAC Name: (2S,3R)-N-butyl-3-(4-chlorophenyl)-4-(4-methylphenyl)-2,3-dihydroazete-2-carboxamide Traditional Name: (2S,3R)-N-butyl-3-(4-chlorophenyl)-4-(p-tolyl)-2,3-dihydroazete-2-carboxamide Formula: C21H23ClN2O MolecularWeight: 354.87312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1C(C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCNC(=O)[C@@H]1[C@H](C(=N1)C2=CC=C(C=C2)C)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H23ClN2O/c1-3-4-13-23-21(25)20-18(15-9-11-17(22)12-10-15)19(24-20)16-7-5-14(2)6-8-16/h5-12,18,20H,3-4,13H2,1-2H3,(H,23,25)/t18-,20-/m0/s1