N-(2-methylquinolin-8-yl)-1-pteridin-4-yl-piperidine-4-carboxamide

Systemtic Name: N-(2-methylquinolin-8-yl)-1-pteridin-4-yl-piperidine-4-carboxamide Openeye Name: N-(2-methyl-8-quinolyl)-1-pteridin-4-yl-piperidine-4-carboxamide CAS Name: N-(2-methyl-8-quinolinyl)-1-(4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-(2-methylquinolin-8-yl)-1-pteridin-4-ylpiperidine-4-carboxamide Traditional Name: N-(2-methyl-8-quinolyl)-1-pteridin-4-yl-isonipecotamide Formula: C22H21N7O MolecularWeight: 399.44844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C=CC=C2NC(=O)C3CCN(CC3)C4=NC=NC5=NC=CN=C54)C=C1

Isomeric SMILES

CC1=NC2=C(C=CC=C2NC(=O)C3CCN(CC3)C4=NC=NC5=NC=CN=C54)C=C1

InChI

InChI=1S/C22H21N7O/c1-14-5-6-15-3-2-4-17(18(15)27-14)28-22(30)16-7-11-29(12-8-16)21-19-20(25-13-26-21)24-10-9-23-19/h2-6,9-10,13,16H,7-8,11-12H2,1H3,(H,28,30)