N-[2-[4-[3-(2-azanyl-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]ethyl]-2-piperidin-1-yl-ethanamide

Systemtic Name: N-[2-[4-[3-(2-azanyl-4-oxidanylidene-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]ethyl]-2-piperidin-1-yl-ethanamide Openeye Name: N-[2-[4-[3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]ethyl]-2-(1-piperidyl)acetamide CAS Name: N-[2-[4-[3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]ethyl]-2-(1-piperidinyl)acetamide IUPAC Name: N-[2-[4-[3-(2-amino-4-oxo-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]ethyl]-2-piperidin-1-ylacetamide Traditional Name: N-[2-[4-[3-(2-amino-4-keto-6-phenyl-1H-pyrimidin-5-yl)propylamino]phenyl]ethyl]-2-piperidino-acetamide Formula: C28H36N6O2 MolecularWeight: 488.62444

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC(=O)NCCC2=CC=C(C=C2)NCCCC3=C(NC(=NC3=O)N)C4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)CC(=O)NCCC2=CC=C(C=C2)NCCCC3=C(NC(=NC3=O)N)C4=CC=CC=C4

InChI

InChI=1S/C28H36N6O2/c29-28-32-26(22-8-3-1-4-9-22)24(27(36)33-28)10-7-16-30-23-13-11-21(12-14-23)15-17-31-25(35)20-34-18-5-2-6-19-34/h1,3-4,8-9,11-14,30H,2,5-7,10,15-20H2,(H,31,35)(H3,29,32,33,36)