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

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-N-(phenylmethyl)pyrazine-2-carboxamide Openeye Name: N-benzyl-N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxo-propyl]pyrazine-2-carboxamide CAS Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-N-(phenylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-benzyl-N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]pyrazine-2-carboxamide Traditional Name: N-benzyl-N-[3-(homoveratrylamino)-3-keto-propyl]pyrazinamide Formula: C25H28N4O4 MolecularWeight: 448.51422

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCN(CC2=CC=CC=C2)C(=O)C3=NC=CN=C3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCN(CC2=CC=CC=C2)C(=O)C3=NC=CN=C3)OC

InChI

InChI=1S/C25H28N4O4/c1-32-22-9-8-19(16-23(22)33-2)10-12-28-24(30)11-15-29(18-20-6-4-3-5-7-20)25(31)21-17-26-13-14-27-21/h3-9,13-14,16-17H,10-12,15,18H2,1-2H3,(H,28,30)