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

Systemtic Name: 2-[4-[(1,3-benzothiazol-2-ylmethylamino)methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one Openeye Name: 2-[4-[(1,3-benzothiazol-2-ylmethylamino)methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one CAS Name: 2-[4-[(1,3-benzothiazol-2-ylmethylamino)methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one IUPAC Name: 2-[4-[(1,3-benzothiazol-2-ylmethylamino)methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one Traditional Name: 2-[4-[(1,3-benzothiazol-2-ylmethylamino)methyl]phenyl]-3-phenyl-6H-1,6-naphthyridin-5-one Formula: C29H22N4OS MolecularWeight: 474.57618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=C3C=CNC(=O)C3=C2)C4=CC=C(C=C4)CNCC5=NC6=CC=CC=C6S5

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=C3C=CNC(=O)C3=C2)C4=CC=C(C=C4)CNCC5=NC6=CC=CC=C6S5

InChI

InChI=1S/C29H22N4OS/c34-29-23-16-22(20-6-2-1-3-7-20)28(33-24(23)14-15-31-29)21-12-10-19(11-13-21)17-30-18-27-32-25-8-4-5-9-26(25)35-27/h1-16,30H,17-18H2,(H,31,34)