1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]urea

Systemtic Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(dimethylamino)-2-thiophen-2-yl-ethyl]urea Openeye Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(dimethylamino)-2-(2-thienyl)ethyl]urea CAS Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(dimethylamino)-2-thiophen-2-ylethyl]urea IUPAC Name: 1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(dimethylamino)-2-thiophen-2-ylethyl]urea Traditional Name: 1-[2-(dimethylamino)-2-(2-thienyl)ethyl]-3-piperonyl-urea Formula: C17H21N3O3S MolecularWeight: 347.43194

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)NCC1=CC2=C(C=C1)OCO2)C3=CC=CS3

Isomeric SMILES

CN(C)C(CNC(=O)NCC1=CC2=C(C=C1)OCO2)C3=CC=CS3

InChI

InChI=1S/C17H21N3O3S/c1-20(2)13(16-4-3-7-24-16)10-19-17(21)18-9-12-5-6-14-15(8-12)23-11-22-14/h3-8,13H,9-11H2,1-2H3,(H2,18,19,21)