5-(4-chlorophenyl)-1-pent-2-ynyl-pyrimidin-2-one

Systemtic Name: 5-(4-chlorophenyl)-1-pent-2-ynyl-pyrimidin-2-one Openeye Name: 5-(4-chlorophenyl)-1-pent-2-ynyl-pyrimidin-2-one CAS Name: 5-(4-chlorophenyl)-1-pent-2-ynyl-2-pyrimidinone IUPAC Name: 5-(4-chlorophenyl)-1-pent-2-ynylpyrimidin-2-one Traditional Name: 5-(4-chlorophenyl)-1-pent-2-ynyl-pyrimidin-2-one Formula: C15H13ClN2O MolecularWeight: 272.72952

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Descriptors Computed from Structure

Canonical SMILES:

CCC#CCN1C=C(C=NC1=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CCC#CCN1C=C(C=NC1=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C15H13ClN2O/c1-2-3-4-9-18-11-13(10-17-15(18)19)12-5-7-14(16)8-6-12/h5-8,10-11H,2,9H2,1H3