N-[7-iodanyl-5-(3-methylphenyl)-3-phenyl-4-piperidin-1-yl-5,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-6-yl]pyridine-4-carboxamide

Systemtic Name: N-[7-iodanyl-5-(3-methylphenyl)-3-phenyl-4-piperidin-1-yl-5,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-6-yl]pyridine-4-carboxamide Openeye Name: N-[7-iodo-5-(m-tolyl)-3-phenyl-4-(1-piperidyl)-5,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-6-yl]pyridine-4-carboxamide CAS Name: N-[7-iodo-5-(3-methylphenyl)-3-phenyl-4-(1-piperidinyl)-5,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-6-yl]-4-pyridinecarboxamide IUPAC Name: N-[7-iodo-5-(3-methylphenyl)-3-phenyl-4-piperidin-1-yl-5,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-6-yl]pyridine-4-carboxamide Traditional Name: N-[7-iodo-5-(m-tolyl)-3-phenyl-4-piperidino-5,7-dihydro-1H-pyrazolo[4,3-d]pyrimidin-6-yl]isonicotinamide Formula: C29H30IN7O MolecularWeight: 619.49927

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2N(C(C3=C(N2N4CCCCC4)C(=NN3)C5=CC=CC=C5)I)NC(=O)C6=CC=NC=C6

Isomeric SMILES

CC1=CC=CC(=C1)C2N(C(C3=C(N2N4CCCCC4)C(=NN3)C5=CC=CC=C5)I)NC(=O)C6=CC=NC=C6

InChI

InChI=1S/C29H30IN7O/c1-20-9-8-12-23(19-20)29-36(34-28(38)22-13-15-31-16-14-22)27(30)25-26(37(29)35-17-6-3-7-18-35)24(32-33-25)21-10-4-2-5-11-21/h2,4-5,8-16,19,27,29H,3,6-7,17-18H2,1H3,(H,32,33)(H,34,38)