7-[4-[4-(2,1,3-benzothiadiazol-4-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one

Systemtic Name: 7-[4-[4-(2,1,3-benzothiadiazol-4-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one Openeye Name: 7-[4-[4-(2,1,3-benzothiadiazol-4-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one CAS Name: 7-[4-[4-(2,1,3-benzothiadiazol-4-yl)-1-piperazinyl]butoxy]-1H-1,8-naphthyridin-2-one IUPAC Name: 7-[4-[4-(2,1,3-benzothiadiazol-4-yl)piperazin-1-yl]butoxy]-1H-1,8-naphthyridin-2-one Traditional Name: 7-[4-(4-piazthiol-4-ylpiperazino)butoxy]-1H-1,8-naphthyridin-2-one Formula: C22H24N6O2S MolecularWeight: 436.52996

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCOC2=NC3=C(C=CC(=O)N3)C=C2)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1CCCCOC2=NC3=C(C=CC(=O)N3)C=C2)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C22H24N6O2S/c29-19-8-6-16-7-9-20(24-22(16)23-19)30-15-2-1-10-27-11-13-28(14-12-27)18-5-3-4-17-21(18)26-31-25-17/h3-9H,1-2,10-15H2,(H,23,24,29)