4-cyano-N-[(3R)-1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]pyrrolidin-3-yl]benzamide

Systemtic Name: 4-cyano-N-[(3R)-1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]pyrrolidin-3-yl]benzamide Openeye Name: 4-cyano-N-[(3R)-1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]pyrrolidin-3-yl]benzamide CAS Name: 4-cyano-N-[(3R)-1-[[4-(3-phenyl-2-quinoxalinyl)phenyl]methyl]-3-pyrrolidinyl]benzamide IUPAC Name: 4-cyano-N-[(3R)-1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]pyrrolidin-3-yl]benzamide Traditional Name: 4-cyano-N-[(3R)-1-[4-(3-phenylquinoxalin-2-yl)benzyl]pyrrolidin-3-yl]benzamide Formula: C33H27N5O MolecularWeight: 509.60038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1NC(=O)C2=CC=C(C=C2)C#N)CC3=CC=C(C=C3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6

Isomeric SMILES

C1CN(C[C@@H]1NC(=O)C2=CC=C(C=C2)C#N)CC3=CC=C(C=C3)C4=NC5=CC=CC=C5N=C4C6=CC=CC=C6

InChI

InChI=1S/C33H27N5O/c34-20-23-10-16-27(17-11-23)33(39)35-28-18-19-38(22-28)21-24-12-14-26(15-13-24)32-31(25-6-2-1-3-7-25)36-29-8-4-5-9-30(29)37-32/h1-17,28H,18-19,21-22H2,(H,35,39)/t28-/m1/s1