N-butyl-N-(phenylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-butyl-N-(phenylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-benzyl-N-butyl-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-butyl-N-(phenylmethyl)-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-benzyl-N-butyl-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-benzyl-N-butyl-piazthiole-4-sulfonamide Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C17H19N3O2S2/c1-2-3-12-20(13-14-8-5-4-6-9-14)24(21,22)16-11-7-10-15-17(16)19-23-18-15/h4-11H,2-3,12-13H2,1H3