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

Systemtic Name: 3-azanyl-N-[[1-[(E)-N'-isocyanocarbamimidoyl]-4-phenyl-piperidin-4-yl]methyl]pyrazine-2-carboxamide Openeye Name: 3-amino-N-[[1-[(E)-N'-isocyanocarbamimidoyl]-4-phenyl-4-piperidyl]methyl]pyrazine-2-carboxamide CAS Name: 3-amino-N-[[1-[(E)-amino(isocyanoimino)methyl]-4-phenyl-4-piperidinyl]methyl]-2-pyrazinecarboxamide IUPAC Name: 3-amino-N-[[1-[(E)-N'-isocyanocarbamimidoyl]-4-phenylpiperidin-4-yl]methyl]pyrazine-2-carboxamide Traditional Name: 3-amino-N-[[1-[(E)-N'-isocyanoamidino]-4-phenyl-4-piperidyl]methyl]pyrazinamide Formula: C19H22N8O MolecularWeight: 378.43098

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]N=C(N)N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3

Isomeric SMILES

[C-]#[N+]/N=C(\N)/N1CCC(CC1)(CNC(=O)C2=NC=CN=C2N)C3=CC=CC=C3

InChI

InChI=1S/C19H22N8O/c1-22-26-18(21)27-11-7-19(8-12-27,14-5-3-2-4-6-14)13-25-17(28)15-16(20)24-10-9-23-15/h2-6,9-10H,7-8,11-13H2,(H2,20,24)(H2,21,26)(H,25,28)