3-azanyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[[4-(1-imidazolylmethyl)phenyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[[4-(imidazol-1-ylmethyl)phenyl]methyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[4-(imidazol-1-ylmethyl)benzyl]pyrazinamide Formula: C16H16N6O MolecularWeight: 308.33784

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=NC=CN=C2N)CN3C=CN=C3

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=NC=CN=C2N)CN3C=CN=C3

InChI

InChI=1S/C16H16N6O/c17-15-14(19-5-6-20-15)16(23)21-9-12-1-3-13(4-2-12)10-22-8-7-18-11-22/h1-8,11H,9-10H2,(H2,17,20)(H,21,23)