4-[4-[(5-bromanylpyrimidin-2-yl)amino]-2-methyl-5-oxidanylidene-oxolan-2-yl]benzenecarbonitrile

Systemtic Name: 4-[4-[(5-bromanylpyrimidin-2-yl)amino]-2-methyl-5-oxidanylidene-oxolan-2-yl]benzenecarbonitrile Openeye Name: 4-[4-[(5-bromopyrimidin-2-yl)amino]-2-methyl-5-oxo-tetrahydrofuran-2-yl]benzonitrile CAS Name: 4-[4-[(5-bromo-2-pyrimidinyl)amino]-2-methyl-5-oxo-2-oxolanyl]benzonitrile IUPAC Name: 4-[4-[(5-bromopyrimidin-2-yl)amino]-2-methyl-5-oxooxolan-2-yl]benzonitrile Traditional Name: 4-[4-[(5-bromopyrimidin-2-yl)amino]-5-keto-2-methyl-tetrahydrofuran-2-yl]benzonitrile Formula: C16H13BrN4O2 MolecularWeight: 373.20402

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)NC2=NC=C(C=N2)Br)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC1(CC(C(=O)O1)NC2=NC=C(C=N2)Br)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C16H13BrN4O2/c1-16(11-4-2-10(7-18)3-5-11)6-13(14(22)23-16)21-15-19-8-12(17)9-20-15/h2-5,8-9,13H,6H2,1H3,(H,19,20,21)