6-chloranyl-5-methyl-2-phenyl-3-prop-2-ynyl-pyrimidin-4-one

Systemtic Name: 6-chloranyl-5-methyl-2-phenyl-3-prop-2-ynyl-pyrimidin-4-one Openeye Name: 6-chloro-5-methyl-2-phenyl-3-prop-2-ynyl-pyrimidin-4-one CAS Name: 6-chloro-5-methyl-2-phenyl-3-prop-2-ynyl-4-pyrimidinone IUPAC Name: 6-chloro-5-methyl-2-phenyl-3-prop-2-ynylpyrimidin-4-one Traditional Name: 6-chloro-5-methyl-2-phenyl-3-propargyl-pyrimidin-4-one Formula: C14H11ClN2O MolecularWeight: 258.70294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(N(C1=O)CC#C)C2=CC=CC=C2)Cl

Isomeric SMILES

CC1=C(N=C(N(C1=O)CC#C)C2=CC=CC=C2)Cl

InChI

InChI=1S/C14H11ClN2O/c1-3-9-17-13(11-7-5-4-6-8-11)16-12(15)10(2)14(17)18/h1,4-8H,9H2,2H3