N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylethylamino)-2-sulfanylidene-ethanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylethylamino)-2-sulfanylidene-ethanamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylethylamino)-2-thioxo-acetamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylethylamino)-2-sulfanylideneacetamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-(1-phenylethylamino)-2-sulfanylideneacetamide Traditional Name: 2-(1-phenylethylamino)-N-piperonyl-2-thioxo-acetamide Formula: C18H18N2O3S MolecularWeight: 342.41212

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=S)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C1=CC=CC=C1)NC(=S)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H18N2O3S/c1-12(14-5-3-2-4-6-14)20-18(24)17(21)19-10-13-7-8-15-16(9-13)23-11-22-15/h2-9,12H,10-11H2,1H3,(H,19,21)(H,20,24)