2-[3-(2-methylpiperidin-1-yl)propylamino]-N-(oxolan-2-ylmethyl)-4-(phenethylamino)pyrimidine-5-carboxamide

Systemtic Name: 2-[3-(2-methylpiperidin-1-yl)propylamino]-N-(oxolan-2-ylmethyl)-4-(phenethylamino)pyrimidine-5-carboxamide Openeye Name: 2-[3-(2-methyl-1-piperidyl)propylamino]-4-(phenethylamino)-N-(tetrahydrofuran-2-ylmethyl)pyrimidine-5-carboxamide CAS Name: 2-[3-(2-methyl-1-piperidinyl)propylamino]-N-(2-oxolanylmethyl)-4-(phenethylamino)-5-pyrimidinecarboxamide IUPAC Name: 2-[3-(2-methylpiperidin-1-yl)propylamino]-N-(oxolan-2-ylmethyl)-4-(phenethylamino)pyrimidine-5-carboxamide Traditional Name: 2-[3-(2-methylpiperidino)propylamino]-4-(phenethylamino)-N-(tetrahydrofurfuryl)pyrimidine-5-carboxamide Formula: C27H40N6O2 MolecularWeight: 480.6455

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC2=NC=C(C(=N2)NCCC3=CC=CC=C3)C(=O)NCC4CCCO4

Isomeric SMILES

CC1CCCCN1CCCNC2=NC=C(C(=N2)NCCC3=CC=CC=C3)C(=O)NCC4CCCO4

InChI

InChI=1S/C27H40N6O2/c1-21-9-5-6-16-33(21)17-8-14-29-27-31-20-24(26(34)30-19-23-12-7-18-35-23)25(32-27)28-15-13-22-10-3-2-4-11-22/h2-4,10-11,20-21,23H,5-9,12-19H2,1H3,(H,30,34)(H2,28,29,31,32)