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

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pteridin-4-yl-piperidine-4-carboxamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pteridin-4-yl-piperidine-4-carboxamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-(4-pteridinyl)-4-piperidinecarboxamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pteridin-4-ylpiperidine-4-carboxamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-pteridin-4-yl-isonipecotamide Formula: C20H20N6O3 MolecularWeight: 392.4112

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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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N6O3/c27-20(25-14-1-2-15-16(11-14)29-10-9-28-15)13-3-7-26(8-4-13)19-17-18(23-12-24-19)22-6-5-21-17/h1-2,5-6,11-13H,3-4,7-10H2,(H,25,27)