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

Systemtic Name: N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]-2,1,3-benzothiadiazole-5-carboxamide Openeye Name: N-[2-[1-(p-tolylsulfonyl)-2-piperidyl]ethyl]-2,1,3-benzothiadiazole-5-carboxamide CAS Name: N-[2-[1-(4-methylphenyl)sulfonyl-2-piperidinyl]ethyl]-2,1,3-benzothiadiazole-5-carboxamide IUPAC Name: N-[2-[1-(4-methylphenyl)sulfonylpiperidin-2-yl]ethyl]-2,1,3-benzothiadiazole-5-carboxamide Traditional Name: N-[2-(1-tosyl-2-piperidyl)ethyl]piazthiole-5-carboxamide Formula: C21H24N4O3S2 MolecularWeight: 444.57026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)C3=CC4=NSN=C4C=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCCC2CCNC(=O)C3=CC4=NSN=C4C=C3

InChI

InChI=1S/C21H24N4O3S2/c1-15-5-8-18(9-6-15)30(27,28)25-13-3-2-4-17(25)11-12-22-21(26)16-7-10-19-20(14-16)24-29-23-19/h5-10,14,17H,2-4,11-13H2,1H3,(H,22,26)