6-azanyl-N-[1-[3-(3-azanyl-1,2-benzoxazol-6-yl)phenyl]-2-phenyl-ethyl]pyridine-3-carboxamide

Systemtic Name: 6-azanyl-N-[1-[3-(3-azanyl-1,2-benzoxazol-6-yl)phenyl]-2-phenyl-ethyl]pyridine-3-carboxamide Openeye Name: 6-amino-N-[1-[3-(3-amino-1,2-benzoxazol-6-yl)phenyl]-2-phenyl-ethyl]pyridine-3-carboxamide CAS Name: 6-amino-N-[1-[3-(3-amino-1,2-benzoxazol-6-yl)phenyl]-2-phenylethyl]-3-pyridinecarboxamide IUPAC Name: 6-amino-N-[1-[3-(3-amino-1,2-benzoxazol-6-yl)phenyl]-2-phenylethyl]pyridine-3-carboxamide Traditional Name: 6-amino-N-[1-[3-(3-aminoindoxazen-6-yl)phenyl]-2-phenyl-ethyl]nicotinamide Formula: C27H23N5O2 MolecularWeight: 449.50382

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C2=CC=CC(=C2)C3=CC4=C(C=C3)C(=NO4)N)NC(=O)C5=CN=C(C=C5)N

Isomeric SMILES

C1=CC=C(C=C1)CC(C2=CC=CC(=C2)C3=CC4=C(C=C3)C(=NO4)N)NC(=O)C5=CN=C(C=C5)N

InChI

InChI=1S/C27H23N5O2/c28-25-12-10-21(16-30-25)27(33)31-23(13-17-5-2-1-3-6-17)20-8-4-7-18(14-20)19-9-11-22-24(15-19)34-32-26(22)29/h1-12,14-16,23H,13H2,(H2,28,30)(H2,29,32)(H,31,33)