1-phenyl-2-(3-phenylpyrazin-2-yl)-2-sulfanyl-ethanone

Systemtic Name: 1-phenyl-2-(3-phenylpyrazin-2-yl)-2-sulfanyl-ethanone Openeye Name: 1-phenyl-2-(3-phenylpyrazin-2-yl)-2-sulfanyl-ethanone CAS Name: 2-mercapto-1-phenyl-2-(3-phenyl-2-pyrazinyl)ethanone IUPAC Name: 1-phenyl-2-(3-phenylpyrazin-2-yl)-2-sulfanylethanone Traditional Name: 2-mercapto-1-phenyl-2-(3-phenylpyrazin-2-yl)ethanone Formula: C18H14N2OS MolecularWeight: 306.38156

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=CN=C2C(C(=O)C3=CC=CC=C3)S

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=CN=C2C(C(=O)C3=CC=CC=C3)S

InChI

InChI=1S/C18H14N2OS/c21-17(14-9-5-2-6-10-14)18(22)16-15(19-11-12-20-16)13-7-3-1-4-8-13/h1-12,18,22H