N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(thiophen-2-ylsulfonylamino)propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(thiophen-2-ylsulfonylamino)propanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(2-thienylsulfonylamino)propanamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(thiophen-2-ylsulfonylamino)propanamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-3-phenyl-2-(thiophen-2-ylsulfonylamino)propanamide Traditional Name: 3-phenyl-N-piperonyl-2-(2-thienylsulfonylamino)propionamide Formula: C21H20N2O5S2 MolecularWeight: 444.5239

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)C(CC3=CC=CC=C3)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C21H20N2O5S2/c24-21(22-13-16-8-9-18-19(12-16)28-14-27-18)17(11-15-5-2-1-3-6-15)23-30(25,26)20-7-4-10-29-20/h1-10,12,17,23H,11,13-14H2,(H,22,24)