2-[4-(4-chloranylphenoxy)-7-phenyl-thieno[3,2-d]pyrimidin-6-yl]sulfanylethanenitrile

Systemtic Name: 2-[4-(4-chloranylphenoxy)-7-phenyl-thieno[3,2-d]pyrimidin-6-yl]sulfanylethanenitrile Openeye Name: 2-[4-(4-chlorophenoxy)-7-phenyl-thieno[3,2-d]pyrimidin-6-yl]sulfanylacetonitrile CAS Name: 2-[[4-(4-chlorophenoxy)-7-phenyl-6-thieno[3,2-d]pyrimidinyl]thio]acetonitrile IUPAC Name: 2-[4-(4-chlorophenoxy)-7-phenylthieno[3,2-d]pyrimidin-6-yl]sulfanylacetonitrile Traditional Name: 2-[[4-(4-chlorophenoxy)-7-phenyl-thieno[3,2-d]pyrimidin-6-yl]thio]acetonitrile Formula: C20H12ClN3OS2 MolecularWeight: 409.91178

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(SC3=C2N=CN=C3OC4=CC=C(C=C4)Cl)SCC#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C(SC3=C2N=CN=C3OC4=CC=C(C=C4)Cl)SCC#N

InChI

InChI=1S/C20H12ClN3OS2/c21-14-6-8-15(9-7-14)25-19-18-17(23-12-24-19)16(13-4-2-1-3-5-13)20(27-18)26-11-10-22/h1-9,12H,11H2