N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-N-propyl-pyrazine-2-carboxamide

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-N-propyl-pyrazine-2-carboxamide Openeye Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxo-propyl]-N-propyl-pyrazine-2-carboxamide CAS Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-N-propyl-2-pyrazinecarboxamide IUPAC Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-N-propylpyrazine-2-carboxamide Traditional Name: N-[3-(homoveratrylamino)-3-keto-propyl]-N-propyl-pyrazinamide Formula: C21H28N4O4 MolecularWeight: 400.47142

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC(=O)NCCC1=CC(=C(C=C1)OC)OC)C(=O)C2=NC=CN=C2

Isomeric SMILES

CCCN(CCC(=O)NCCC1=CC(=C(C=C1)OC)OC)C(=O)C2=NC=CN=C2

InChI

InChI=1S/C21H28N4O4/c1-4-12-25(21(27)17-15-22-10-11-23-17)13-8-20(26)24-9-7-16-5-6-18(28-2)19(14-16)29-3/h5-6,10-11,14-15H,4,7-9,12-13H2,1-3H3,(H,24,26)