N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloranyl-3-(pyridin-3-ylmethylsulfamoyl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-(3-pyridylmethylsulfamoyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-(3-pyridinylmethylsulfamoyl)benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-chloro-3-(pyridin-3-ylmethylsulfamoyl)benzamide Traditional Name: 4-chloro-N-piperonyl-3-(3-pyridylmethylsulfamoyl)benzamide Formula: C21H18ClN3O5S MolecularWeight: 459.90272

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C3=CC(=C(C=C3)Cl)S(=O)(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H18ClN3O5S/c22-17-5-4-16(9-20(17)31(27,28)25-12-15-2-1-7-23-10-15)21(26)24-11-14-3-6-18-19(8-14)30-13-29-18/h1-10,25H,11-13H2,(H,24,26)