3-azanyl-6-[4-(4-methylpiperazin-1-yl)carbonylphenyl]-N-pyridin-3-yl-pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-6-[4-(4-methylpiperazin-1-yl)carbonylphenyl]-N-pyridin-3-yl-pyrazine-2-carboxamide Openeye Name: 3-amino-6-[4-(4-methylpiperazine-1-carbonyl)phenyl]-N-(3-pyridyl)pyrazine-2-carboxamide CAS Name: 3-amino-6-[4-[(4-methyl-1-piperazinyl)-oxomethyl]phenyl]-N-(3-pyridinyl)-2-pyrazinecarboxamide IUPAC Name: 3-amino-6-[4-(4-methylpiperazine-1-carbonyl)phenyl]-N-pyridin-3-ylpyrazine-2-carboxamide Traditional Name: 3-amino-6-[4-(4-methylpiperazine-1-carbonyl)phenyl]-N-(3-pyridyl)pyrazinamide Formula: C22H23N7O2 MolecularWeight: 417.46372

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N

Isomeric SMILES

CN1CCN(CC1)C(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N

InChI

InChI=1S/C22H23N7O2/c1-28-9-11-29(12-10-28)22(31)16-6-4-15(5-7-16)18-14-25-20(23)19(27-18)21(30)26-17-3-2-8-24-13-17/h2-8,13-14H,9-12H2,1H3,(H2,23,25)(H,26,30)