2-[2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-4-oxidanylidene-1H-pyrimidin-6-yl]-2-naphthalen-1-yl-ethanenitrile

Systemtic Name: 2-[2-[2-(4-chlorophenyl)-2-oxidanylidene-ethyl]sulfanyl-5-ethyl-4-oxidanylidene-1H-pyrimidin-6-yl]-2-naphthalen-1-yl-ethanenitrile Openeye Name: 2-[2-[2-(4-chlorophenyl)-2-oxo-ethyl]sulfanyl-5-ethyl-4-oxo-1H-pyrimidin-6-yl]-2-(1-naphthyl)acetonitrile CAS Name: 2-[2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-5-ethyl-4-oxo-1H-pyrimidin-6-yl]-2-(1-naphthalenyl)acetonitrile IUPAC Name: 2-[2-[2-(4-chlorophenyl)-2-oxoethyl]sulfanyl-5-ethyl-4-oxo-1H-pyrimidin-6-yl]-2-naphthalen-1-ylacetonitrile Traditional Name: 2-[2-[[2-(4-chlorophenyl)-2-keto-ethyl]thio]-5-ethyl-4-keto-1H-pyrimidin-6-yl]-2-(1-naphthyl)acetonitrile Formula: C26H20ClN3O2S MolecularWeight: 473.9739

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)Cl)C(C#N)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC1=C(NC(=NC1=O)SCC(=O)C2=CC=C(C=C2)Cl)C(C#N)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C26H20ClN3O2S/c1-2-19-24(22(14-28)21-9-5-7-16-6-3-4-8-20(16)21)29-26(30-25(19)32)33-15-23(31)17-10-12-18(27)13-11-17/h3-13,22H,2,15H2,1H3,(H,29,30,32)