(E)-1-(4-chlorophenyl)-3-pyrimidin-2-ylsulfanyl-prop-2-en-1-one

Systemtic Name: (E)-1-(4-chlorophenyl)-3-pyrimidin-2-ylsulfanyl-prop-2-en-1-one Openeye Name: (E)-1-(4-chlorophenyl)-3-pyrimidin-2-ylsulfanyl-prop-2-en-1-one CAS Name: (E)-1-(4-chlorophenyl)-3-(2-pyrimidinylthio)-2-propen-1-one IUPAC Name: (E)-1-(4-chlorophenyl)-3-pyrimidin-2-ylsulfanylprop-2-en-1-one Traditional Name: (E)-1-(4-chlorophenyl)-3-(2-pyrimidylthio)prop-2-en-1-one Formula: C13H9ClN2OS MolecularWeight: 276.74136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1)SC=CC(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

C1=CN=C(N=C1)S/C=C/C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C13H9ClN2OS/c14-11-4-2-10(3-5-11)12(17)6-9-18-13-15-7-1-8-16-13/h1-9H/b9-6+