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

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-(phenylmethyl)pyrazine-2-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-N-benzyl-pyrazine-2-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-(phenylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-benzylpyrazine-2-carboxamide Traditional Name: N-benzyl-N-[3-keto-3-(piperonylamino)propyl]pyrazinamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN(CC3=CC=CC=C3)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CNC(=O)CCN(CC3=CC=CC=C3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C23H22N4O4/c28-22(26-13-18-6-7-20-21(12-18)31-16-30-20)8-11-27(15-17-4-2-1-3-5-17)23(29)19-14-24-9-10-25-19/h1-7,9-10,12,14H,8,11,13,15-16H2,(H,26,28)