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

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-N-(2-methylpropyl)pyrazine-2-carboxamide Openeye Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxo-propyl]-N-isobutyl-pyrazine-2-carboxamide CAS Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-N-(2-methylpropyl)-2-pyrazinecarboxamide IUPAC Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-N-(2-methylpropyl)pyrazine-2-carboxamide Traditional Name: N-[3-(homoveratrylamino)-3-keto-propyl]-N-isobutyl-pyrazinamide Formula: C22H30N4O4 MolecularWeight: 414.498

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O4/c1-16(2)15-26(22(28)18-14-23-10-11-24-18)12-8-21(27)25-9-7-17-5-6-19(29-3)20(13-17)30-4/h5-6,10-11,13-14,16H,7-9,12,15H2,1-4H3,(H,25,27)