N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-butyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-butyl-pyrazine-2-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-N-butyl-pyrazine-2-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-butyl-2-pyrazinecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-butylpyrazine-2-carboxamide Traditional Name: N-butyl-N-[3-keto-3-(piperonylamino)propyl]pyrazinamide Formula: C20H24N4O4 MolecularWeight: 384.42896

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCC(=O)NCC1=CC2=C(C=C1)OCO2)C(=O)C3=NC=CN=C3

Isomeric SMILES

CCCCN(CCC(=O)NCC1=CC2=C(C=C1)OCO2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C20H24N4O4/c1-2-3-9-24(20(26)16-13-21-7-8-22-16)10-6-19(25)23-12-15-4-5-17-18(11-15)28-14-27-17/h4-5,7-8,11,13H,2-3,6,9-10,12,14H2,1H3,(H,23,25)