N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-2,1,3-benzothiadiazole-5-carboxamide

Systemtic Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-yl-ethyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[2-(p-tolylsulfonyl)-2-(2-thienyl)ethyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[2-(4-methylphenyl)sulfonyl-2-thiophen-2-ylethyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[2-(2-thienyl)-2-tosyl-ethyl]piazthiole-5-carboxamide Formula: C20H17N3O3S3 MolecularWeight: 443.56228

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC3=NSN=C3C=C2)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(CNC(=O)C2=CC3=NSN=C3C=C2)C4=CC=CS4

InChI

InChI=1S/C20H17N3O3S3/c1-13-4-7-15(8-5-13)29(25,26)19(18-3-2-10-27-18)12-21-20(24)14-6-9-16-17(11-14)23-28-22-16/h2-11,19H,12H2,1H3,(H,21,24)