N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[4-[(2-methyl-1-piperidyl)sulfonyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[4-[(2-methyl-1-piperidinyl)sulfonyl]phenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[4-(2-methylpiperidino)sulfonylphenyl]piazthiole-4-sulfonamide Formula: C18H20N4O4S3 MolecularWeight: 452.5708

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H20N4O4S3/c1-13-5-2-3-12-22(13)29(25,26)15-10-8-14(9-11-15)21-28(23,24)17-7-4-6-16-18(17)20-27-19-16/h4,6-11,13,21H,2-3,5,12H2,1H3