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

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-(furan-2-ylmethyl)-5-methyl-pyrazine-2-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-N-(2-furylmethyl)-5-methyl-pyrazine-2-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-(2-furanylmethyl)-5-methyl-2-pyrazinecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-(furan-2-ylmethyl)-5-methylpyrazine-2-carboxamide Traditional Name: N-(2-furfuryl)-N-[3-keto-3-(piperonylamino)propyl]-5-methyl-pyrazinamide Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N=C1)C(=O)N(CCC(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CO4

Isomeric SMILES

CC1=NC=C(N=C1)C(=O)N(CCC(=O)NCC2=CC3=C(C=C2)OCO3)CC4=CC=CO4

InChI

InChI=1S/C22H22N4O5/c1-15-10-24-18(12-23-15)22(28)26(13-17-3-2-8-29-17)7-6-21(27)25-11-16-4-5-19-20(9-16)31-14-30-19/h2-5,8-10,12H,6-7,11,13-14H2,1H3,(H,25,27)