N-[2-(butylamino)-5-cyano-phenyl]pyrazine-2-carboxamide

Systemtic Name: N-[2-(butylamino)-5-cyano-phenyl]pyrazine-2-carboxamide Openeye Name: N-[2-(butylamino)-5-cyano-phenyl]pyrazine-2-carboxamide CAS Name: N-[2-(butylamino)-5-cyanophenyl]-2-pyrazinecarboxamide IUPAC Name: N-[2-(butylamino)-5-cyanophenyl]pyrazine-2-carboxamide Traditional Name: N-[2-(butylamino)-5-cyano-phenyl]pyrazinamide Formula: C16H17N5O MolecularWeight: 295.33908

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)C#N)NC(=O)C2=NC=CN=C2

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)C#N)NC(=O)C2=NC=CN=C2

InChI

InChI=1S/C16H17N5O/c1-2-3-6-19-13-5-4-12(10-17)9-14(13)21-16(22)15-11-18-7-8-20-15/h4-5,7-9,11,19H,2-3,6H2,1H3,(H,21,22)