4-azanyl-N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(8-oxidanylidene-7,9-dihydropurin-6-yl)piperidine-4-carboxamide

Systemtic Name: 4-azanyl-N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(8-oxidanylidene-7,9-dihydropurin-6-yl)piperidine-4-carboxamide Openeye Name: 4-amino-N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(8-oxo-7,9-dihydropurin-6-yl)piperidine-4-carboxamide CAS Name: 4-amino-N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(8-oxo-7,9-dihydropurin-6-yl)-4-piperidinecarboxamide IUPAC Name: 4-amino-N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(8-oxo-7,9-dihydropurin-6-yl)piperidine-4-carboxamide Traditional Name: 4-amino-N-[3-(1,3-benzoxazol-2-yl)phenyl]-1-(8-keto-7,9-dihydropurin-6-yl)isonipecotamide Formula: C24H22N8O3 MolecularWeight: 470.48328

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)N)C5=NC=NC6=C5NC(=O)N6

Isomeric SMILES

C1CN(CCC1(C(=O)NC2=CC=CC(=C2)C3=NC4=CC=CC=C4O3)N)C5=NC=NC6=C5NC(=O)N6

InChI

InChI=1S/C24H22N8O3/c25-24(8-10-32(11-9-24)20-18-19(26-13-27-20)31-23(34)30-18)22(33)28-15-5-3-4-14(12-15)21-29-16-6-1-2-7-17(16)35-21/h1-7,12-13H,8-11,25H2,(H,28,33)(H2,26,27,30,31,34)