1-oxidanylidene-N-[2-(pyrimidin-2-ylamino)ethyl]-3,4-dihydroisochromene-3-carboxamide

Systemtic Name: 1-oxidanylidene-N-[2-(pyrimidin-2-ylamino)ethyl]-3,4-dihydroisochromene-3-carboxamide Openeye Name: 1-oxo-N-[2-(pyrimidin-2-ylamino)ethyl]isochromane-3-carboxamide CAS Name: 1-oxo-N-[2-(2-pyrimidinylamino)ethyl]-3,4-dihydro-1H-2-benzopyran-3-carboxamide IUPAC Name: 1-oxo-N-[2-(pyrimidin-2-ylamino)ethyl]-3,4-dihydroisochromene-3-carboxamide Traditional Name: 1-keto-N-[2-(2-pyrimidylamino)ethyl]isochroman-3-carboxamide Formula: C16H16N4O3 MolecularWeight: 312.32324

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)NCCNC3=NC=CC=N3

Isomeric SMILES

C1C(OC(=O)C2=CC=CC=C21)C(=O)NCCNC3=NC=CC=N3

InChI

InChI=1S/C16H16N4O3/c21-14(17-8-9-20-16-18-6-3-7-19-16)13-10-11-4-1-2-5-12(11)15(22)23-13/h1-7,13H,8-10H2,(H,17,21)(H,18,19,20)