diethyl 2-[[(6-propyl-2-pyridin-4-yl-pyrimidin-4-yl)amino]methylidene]propanedioate

Systemtic Name: diethyl 2-[[(6-propyl-2-pyridin-4-yl-pyrimidin-4-yl)amino]methylidene]propanedioate Openeye Name: diethyl 2-[[[6-propyl-2-(4-pyridyl)pyrimidin-4-yl]amino]methylene]propanedioate CAS Name: 2-[[(6-propyl-2-pyridin-4-yl-4-pyrimidinyl)amino]methylidene]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[(6-propyl-2-pyridin-4-ylpyrimidin-4-yl)amino]methylidene]propanedioate Traditional Name: 2-[[[6-propyl-2-(4-pyridyl)pyrimidin-4-yl]amino]methylene]malonic acid diethyl ester Formula: C20H24N4O4 MolecularWeight: 384.42896

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=NC(=N1)C2=CC=NC=C2)NC=C(C(=O)OCC)C(=O)OCC

Isomeric SMILES

CCCC1=CC(=NC(=N1)C2=CC=NC=C2)NC=C(C(=O)OCC)C(=O)OCC

InChI

InChI=1S/C20H24N4O4/c1-4-7-15-12-17(24-18(23-15)14-8-10-21-11-9-14)22-13-16(19(25)27-5-2)20(26)28-6-3/h8-13H,4-7H2,1-3H3,(H,22,23,24)