N-(4-isocyano-1H-pyrazol-5-yl)-2-(4-methylpiperidin-1-yl)quinazolin-4-amine

Systemtic Name: N-(4-isocyano-1H-pyrazol-5-yl)-2-(4-methylpiperidin-1-yl)quinazolin-4-amine Openeye Name: N-(4-isocyano-1H-pyrazol-5-yl)-2-(4-methyl-1-piperidyl)quinazolin-4-amine CAS Name: N-(4-isocyano-1H-pyrazol-5-yl)-2-(4-methyl-1-piperidinyl)-4-quinazolinamine IUPAC Name: N-(4-isocyano-1H-pyrazol-5-yl)-2-(4-methylpiperidin-1-yl)quinazolin-4-amine Traditional Name: (4-isocyano-1H-pyrazol-5-yl)-[2-(4-methylpiperidino)quinazolin-4-yl]amine Formula: C18H19N7 MolecularWeight: 333.39036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NC4=C(C=NN4)[N+]#[C-]

Isomeric SMILES

CC1CCN(CC1)C2=NC3=CC=CC=C3C(=N2)NC4=C(C=NN4)[N+]#[C-]

InChI

InChI=1S/C18H19N7/c1-12-7-9-25(10-8-12)18-21-14-6-4-3-5-13(14)16(23-18)22-17-15(19-2)11-20-24-17/h3-6,11-12H,7-10H2,1H3,(H2,20,21,22,23,24)