N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(7-phenyl-4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(7-phenylpteridin-4-yl)piperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(7-phenylpteridin-4-yl)isonipecotamide Formula: C26H24N6O3 MolecularWeight: 468.50716

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCCO3)C4=NC=NC5=NC(=CN=C54)C6=CC=CC=C6

Isomeric SMILES

C1CN(CCC1C(=O)NC2=CC3=C(C=C2)OCCO3)C4=NC=NC5=NC(=CN=C54)C6=CC=CC=C6

InChI

InChI=1S/C26H24N6O3/c33-26(30-19-6-7-21-22(14-19)35-13-12-34-21)18-8-10-32(11-9-18)25-23-24(28-16-29-25)31-20(15-27-23)17-4-2-1-3-5-17/h1-7,14-16,18H,8-13H2,(H,30,33)