N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide

Systemtic Name: N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide Openeye Name: N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(3-pyridylmethyl)pyrimidine-4,6-dicarboxamide CAS Name: N6-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N4-(3-pyridinylmethyl)pyrimidine-4,6-dicarboxamide IUPAC Name: 6-N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-4-N-(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide Traditional Name: N'-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-(3-pyridylmethyl)pyrimidine-4,6-dicarboxamide Formula: C21H19N5O4 MolecularWeight: 405.40666

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=NC=N3)C(=O)NCC4=CN=CC=C4

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)CNC(=O)C3=CC(=NC=N3)C(=O)NCC4=CN=CC=C4

InChI

InChI=1S/C21H19N5O4/c27-20(23-11-14-3-4-18-19(8-14)30-7-6-29-18)16-9-17(26-13-25-16)21(28)24-12-15-2-1-5-22-10-15/h1-5,8-10,13H,6-7,11-12H2,(H,23,27)(H,24,28)