(2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide

Systemtic Name: (2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide Openeye Name: (2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide CAS Name: (2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide IUPAC Name: (2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide Traditional Name: (2R,3S)-2-cyano-1,3-dimethyl-N-phenyl-4,5-dihydro-2H-1-benzazepine-3-carboxamide Formula: C20H21N3O MolecularWeight: 319.40024

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCC2=CC=CC=C2N(C1C#N)C)C(=O)NC3=CC=CC=C3

Isomeric SMILES

C[C@@]1(CCC2=CC=CC=C2N([C@H]1C#N)C)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H21N3O/c1-20(19(24)22-16-9-4-3-5-10-16)13-12-15-8-6-7-11-17(15)23(2)18(20)14-21/h3-11,18H,12-13H2,1-2H3,(H,22,24)/t18-,20-/m0/s1