(E)-1-(4-iodophenyl)-3-(4-methylpyrimidin-2-yl)sulfanyl-prop-2-en-1-one

Systemtic Name: (E)-1-(4-iodophenyl)-3-(4-methylpyrimidin-2-yl)sulfanyl-prop-2-en-1-one Openeye Name: (E)-1-(4-iodophenyl)-3-(4-methylpyrimidin-2-yl)sulfanyl-prop-2-en-1-one CAS Name: (E)-1-(4-iodophenyl)-3-[(4-methyl-2-pyrimidinyl)thio]-2-propen-1-one IUPAC Name: (E)-1-(4-iodophenyl)-3-(4-methylpyrimidin-2-yl)sulfanylprop-2-en-1-one Traditional Name: (E)-1-(4-iodophenyl)-3-[(4-methylpyrimidin-2-yl)thio]prop-2-en-1-one Formula: C14H11IN2OS MolecularWeight: 382.21941

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1)SC=CC(=O)C2=CC=C(C=C2)I

Isomeric SMILES

CC1=NC(=NC=C1)S/C=C/C(=O)C2=CC=C(C=C2)I

InChI

InChI=1S/C14H11IN2OS/c1-10-6-8-16-14(17-10)19-9-7-13(18)11-2-4-12(15)5-3-11/h2-9H,1H3/b9-7+