3-azanyl-N-[(4-phenyl-1-pyrimidin-2-yl-piperidin-4-yl)methyl]pyrazine-2-carboxamide

Systemtic Name: 3-azanyl-N-[(4-phenyl-1-pyrimidin-2-yl-piperidin-4-yl)methyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[(4-phenyl-1-pyrimidin-2-yl-4-piperidyl)methyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[[4-phenyl-1-(2-pyrimidinyl)-4-piperidinyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[(4-phenyl-1-pyrimidin-2-ylpiperidin-4-yl)methyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[[4-phenyl-1-(2-pyrimidyl)-4-piperidyl]methyl]pyrazinamide Formula: C21H23N7O MolecularWeight: 389.45362

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3)C4=NC=CC=N4

Isomeric SMILES

C1CN(CCC1(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3)C4=NC=CC=N4

InChI

InChI=1S/C21H23N7O/c22-18-17(23-11-12-24-18)19(29)27-15-21(16-5-2-1-3-6-16)7-13-28(14-8-21)20-25-9-4-10-26-20/h1-6,9-12H,7-8,13-15H2,(H2,22,24)(H,27,29)