(phenylmethyl) N-[1-(2,2-dimethoxyethyl)-6-oxidanylidene-2-pyridin-3-yl-pyrimidin-5-yl]carbamate

Systemtic Name: (phenylmethyl) N-[1-(2,2-dimethoxyethyl)-6-oxidanylidene-2-pyridin-3-yl-pyrimidin-5-yl]carbamate Openeye Name: benzyl N-[1-(2,2-dimethoxyethyl)-6-oxo-2-(3-pyridyl)pyrimidin-5-yl]carbamate CAS Name: N-[1-(2,2-dimethoxyethyl)-6-oxo-2-(3-pyridinyl)-5-pyrimidinyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[1-(2,2-dimethoxyethyl)-6-oxo-2-pyridin-3-ylpyrimidin-5-yl]carbamate Traditional Name: N-[1-(2,2-dimethoxyethyl)-6-keto-2-(3-pyridyl)pyrimidin-5-yl]carbamic acid benzyl ester Formula: C21H22N4O5 MolecularWeight: 410.42318

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Descriptors Computed from Structure

Canonical SMILES:

COC(CN1C(=NC=C(C1=O)NC(=O)OCC2=CC=CC=C2)C3=CN=CC=C3)OC

Isomeric SMILES

COC(CN1C(=NC=C(C1=O)NC(=O)OCC2=CC=CC=C2)C3=CN=CC=C3)OC

InChI

InChI=1S/C21H22N4O5/c1-28-18(29-2)13-25-19(16-9-6-10-22-11-16)23-12-17(20(25)26)24-21(27)30-14-15-7-4-3-5-8-15/h3-12,18H,13-14H2,1-2H3,(H,24,27)