3-[4-[(E)-2-(4-methoxyphenyl)ethenyl]pyrimidin-2-yl]sulfanylpropanenitrile

Systemtic Name: 3-[4-[(E)-2-(4-methoxyphenyl)ethenyl]pyrimidin-2-yl]sulfanylpropanenitrile Openeye Name: 3-[4-[(E)-2-(4-methoxyphenyl)vinyl]pyrimidin-2-yl]sulfanylpropanenitrile CAS Name: 3-[[4-[(E)-2-(4-methoxyphenyl)ethenyl]-2-pyrimidinyl]thio]propanenitrile IUPAC Name: 3-[4-[(E)-2-(4-methoxyphenyl)ethenyl]pyrimidin-2-yl]sulfanylpropanenitrile Traditional Name: 3-[[4-[(E)-2-(4-methoxyphenyl)vinyl]pyrimidin-2-yl]thio]propionitrile Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=NC(=NC=C2)SCCC#N

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=NC(=NC=C2)SCCC#N

InChI

InChI=1S/C16H15N3OS/c1-20-15-7-4-13(5-8-15)3-6-14-9-11-18-16(19-14)21-12-2-10-17/h3-9,11H,2,12H2,1H3/b6-3+