N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-[[(2R)-oxolan-2-yl]methyl]pyrazine-2-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-N-[[(2R)-oxolan-2-yl]methyl]pyrazine-2-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazine-2-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-[[(2R)-2-oxolanyl]methyl]-2-pyrazinecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-N-[[(2R)-oxolan-2-yl]methyl]pyrazine-2-carboxamide Traditional Name: N-[3-keto-3-(piperonylamino)propyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]pyrazinamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(OC1)CN(CCC(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=NC=CN=C4

Isomeric SMILES

C1C[C@@H](OC1)CN(CCC(=O)NCC2=CC3=C(C=C2)OCO3)C(=O)C4=NC=CN=C4

InChI

InChI=1S/C21H24N4O5/c26-20(24-11-15-3-4-18-19(10-15)30-14-29-18)5-8-25(13-16-2-1-9-28-16)21(27)17-12-22-6-7-23-17/h3-4,6-7,10,12,16H,1-2,5,8-9,11,13-14H2,(H,24,26)/t16-/m1/s1