3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]carbonyl-1H-quinolin-2-one

Systemtic Name: 3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]carbonyl-1H-quinolin-2-one Openeye Name: 3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carbonyl]-1H-quinolin-2-one CAS Name: 3-[[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-oxomethyl]-1H-quinolin-2-one IUPAC Name: 3-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazine-1-carbonyl]-1H-quinolin-2-one Traditional Name: 3-(4-piazthiol-4-ylsulfonylpiperazine-1-carbonyl)carbostyril Formula: C20H17N5O4S2 MolecularWeight: 455.51008

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3NC2=O)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC3=CC=CC=C3NC2=O)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C20H17N5O4S2/c26-19-14(12-13-4-1-2-5-15(13)21-19)20(27)24-8-10-25(11-9-24)31(28,29)17-7-3-6-16-18(17)23-30-22-16/h1-7,12H,8-11H2,(H,21,26)