2-[4-[[(4-methylsulfonylphenyl)methylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one

Systemtic Name: 2-[4-[[(4-methylsulfonylphenyl)methylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one Openeye Name: 2-[4-[[(4-methylsulfonylphenyl)methylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one CAS Name: 2-[4-[[(4-methylsulfonylphenyl)methylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one IUPAC Name: 2-[4-[[(4-methylsulfonylphenyl)methylamino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one Traditional Name: 2-[4-[[(4-mesylbenzyl)amino]methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one Formula: C29H25N3O3S MolecularWeight: 495.5921

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)CNCC2=CC=C(C=C2)C3=C(C=C4C(=N3)C=CNC4=O)C5=CC=CC=C5

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)CNCC2=CC=C(C=C2)C3=C(C=C4C(=N3)C=CNC4=O)C5=CC=CC=C5

InChI

InChI=1S/C29H25N3O3S/c1-36(34,35)24-13-9-21(10-14-24)19-30-18-20-7-11-23(12-8-20)28-25(22-5-3-2-4-6-22)17-26-27(32-28)15-16-31-29(26)33/h2-17,30H,18-19H2,1H3,(H,31,33)