7-methyl-3-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-1H-1,8-naphthyridin-4-one

Systemtic Name: 7-methyl-3-[4-(phenylsulfonyl)piperazin-1-yl]carbonyl-1H-1,8-naphthyridin-4-one Openeye Name: 3-[4-(benzenesulfonyl)piperazine-1-carbonyl]-7-methyl-1H-1,8-naphthyridin-4-one CAS Name: 3-[[4-(benzenesulfonyl)-1-piperazinyl]-oxomethyl]-7-methyl-1H-1,8-naphthyridin-4-one IUPAC Name: 3-[4-(benzenesulfonyl)piperazine-1-carbonyl]-7-methyl-1H-1,8-naphthyridin-4-one Traditional Name: 3-(4-besylpiperazine-1-carbonyl)-7-methyl-1H-1,8-naphthyridin-4-one Formula: C20H20N4O4S MolecularWeight: 412.4622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=C1)C(=O)C(=CN2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=NC2=C(C=C1)C(=O)C(=CN2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C20H20N4O4S/c1-14-7-8-16-18(25)17(13-21-19(16)22-14)20(26)23-9-11-24(12-10-23)29(27,28)15-5-3-2-4-6-15/h2-8,13H,9-12H2,1H3,(H,21,22,25)