N-(2-cyanophenyl)-2-(4-oxidanylidene-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-(4-oxidanylidene-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanophenyl)-2-(4-oxo-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(2-cyanophenyl)-2-[(4-oxo-3,6-diphenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-(4-oxo-3,6-diphenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-(2-cyanophenyl)-2-[(4-keto-3,6-diphenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C27H18N4O2S2 MolecularWeight: 494.58742

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)NC5=CC=CC=C5C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=C(N(C3=O)C4=CC=CC=C4)SCC(=O)NC5=CC=CC=C5C#N

InChI

InChI=1S/C27H18N4O2S2/c28-16-19-11-7-8-14-22(19)29-24(32)17-34-27-30-25-21(15-23(35-25)18-9-3-1-4-10-18)26(33)31(27)20-12-5-2-6-13-20/h1-15H,17H2,(H,29,32)