N-[4-[bis(pyridin-2-ylmethyl)amino]but-2-ynyl]-3,3-diphenyl-propanamide

Systemtic Name: N-[4-[bis(pyridin-2-ylmethyl)amino]but-2-ynyl]-3,3-diphenyl-propanamide Openeye Name: N-[4-[bis(2-pyridylmethyl)amino]but-2-ynyl]-3,3-diphenyl-propanamide CAS Name: N-[4-[bis(2-pyridinylmethyl)amino]but-2-ynyl]-3,3-diphenylpropanamide IUPAC Name: N-[4-[bis(pyridin-2-ylmethyl)amino]but-2-ynyl]-3,3-diphenylpropanamide Traditional Name: N-[4-[bis(2-pyridylmethyl)amino]but-2-ynyl]-3,3-diphenyl-propionamide Formula: C31H30N4O MolecularWeight: 474.5961

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NCC#CCN(CC2=CC=CC=N2)CC3=CC=CC=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NCC#CCN(CC2=CC=CC=N2)CC3=CC=CC=N3)C4=CC=CC=C4

InChI

InChI=1S/C31H30N4O/c36-31(23-30(26-13-3-1-4-14-26)27-15-5-2-6-16-27)34-21-11-12-22-35(24-28-17-7-9-19-32-28)25-29-18-8-10-20-33-29/h1-10,13-20,30H,21-25H2,(H,34,36)