N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: N-piperonyl-3-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C25H24N2O5S MolecularWeight: 464.53346

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)C3=CC(=CC=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H24N2O5S/c28-25(26-16-18-6-11-23-24(14-18)32-17-31-23)21-5-3-4-20(15-21)19-7-9-22(10-8-19)33(29,30)27-12-1-2-13-27/h3-11,14-15H,1-2,12-13,16-17H2,(H,26,28)