N-(2-piperidin-1-ylcarbonyl-5-prop-2-enyl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-(2-piperidin-1-ylcarbonyl-5-prop-2-enyl-phenyl)-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[5-allyl-2-(piperidine-1-carbonyl)phenyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-[oxo(1-piperidinyl)methyl]-5-prop-2-enylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(piperidine-1-carbonyl)-5-prop-2-enylphenyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[5-allyl-2-(piperidine-1-carbonyl)phenyl]piazthiole-4-sulfonamide Formula: C21H22N4O3S2 MolecularWeight: 442.55438

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=CC(=C(C=C1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C=CCC1=CC(=C(C=C1)C(=O)N2CCCCC2)NS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H22N4O3S2/c1-2-7-15-10-11-16(21(26)25-12-4-3-5-13-25)18(14-15)24-30(27,28)19-9-6-8-17-20(19)23-29-22-17/h2,6,8-11,14,24H,1,3-5,7,12-13H2