N-[3-oxidanylidene-3-(pyridin-4-ylmethylamino)propyl]-N-(phenylmethyl)pyrazine-2-carboxamide

Systemtic Name: N-[3-oxidanylidene-3-(pyridin-4-ylmethylamino)propyl]-N-(phenylmethyl)pyrazine-2-carboxamide Openeye Name: N-benzyl-N-[3-oxo-3-(4-pyridylmethylamino)propyl]pyrazine-2-carboxamide CAS Name: N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]-N-(phenylmethyl)-2-pyrazinecarboxamide IUPAC Name: N-benzyl-N-[3-oxo-3-(pyridin-4-ylmethylamino)propyl]pyrazine-2-carboxamide Traditional Name: N-benzyl-N-[3-keto-3-(4-pyridylmethylamino)propyl]pyrazinamide Formula: C21H21N5O2 MolecularWeight: 375.42374

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN(CCC(=O)NCC2=CC=NC=C2)C(=O)C3=NC=CN=C3

Isomeric SMILES

C1=CC=C(C=C1)CN(CCC(=O)NCC2=CC=NC=C2)C(=O)C3=NC=CN=C3

InChI

InChI=1S/C21H21N5O2/c27-20(25-14-17-6-9-22-10-7-17)8-13-26(16-18-4-2-1-3-5-18)21(28)19-15-23-11-12-24-19/h1-7,9-12,15H,8,13-14,16H2,(H,25,27)