(E,2S)-5-azanyl-2-[bis(phenylmethyl)amino]-6-phenyl-1-(4-pyridin-2-ylphenyl)hex-4-en-3-one

Systemtic Name: (E,2S)-5-azanyl-2-[bis(phenylmethyl)amino]-6-phenyl-1-(4-pyridin-2-ylphenyl)hex-4-en-3-one Openeye Name: (E,2S)-5-amino-2-(dibenzylamino)-6-phenyl-1-[4-(2-pyridyl)phenyl]hex-4-en-3-one CAS Name: (E,2S)-5-amino-2-[bis(phenylmethyl)amino]-6-phenyl-1-[4-(2-pyridinyl)phenyl]-4-hexen-3-one IUPAC Name: (E,2S)-5-amino-2-(dibenzylamino)-6-phenyl-1-(4-pyridin-2-ylphenyl)hex-4-en-3-one Traditional Name: (E,2S)-5-amino-2-(dibenzylamino)-6-phenyl-1-[4-(2-pyridyl)phenyl]hex-4-en-3-one Formula: C37H35N3O MolecularWeight: 537.6933

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=CC(=O)C(CC2=CC=C(C=C2)C3=CC=CC=N3)N(CC4=CC=CC=C4)CC5=CC=CC=C5)N

Isomeric SMILES

C1=CC=C(C=C1)C/C(=C\C(=O)[C@H](CC2=CC=C(C=C2)C3=CC=CC=N3)N(CC4=CC=CC=C4)CC5=CC=CC=C5)/N

InChI

InChI=1S/C37H35N3O/c38-34(24-29-12-4-1-5-13-29)26-37(41)36(25-30-19-21-33(22-20-30)35-18-10-11-23-39-35)40(27-31-14-6-2-7-15-31)28-32-16-8-3-9-17-32/h1-23,26,36H,24-25,27-28,38H2/b34-26+/t36-/m0/s1