5-(4-chlorophenyl)-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one; N,N-dimethylmethanamide

Systemtic Name: 5-(4-chlorophenyl)-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one; N,N-dimethylmethanamide Openeye Name: 5-(4-chlorophenyl)-3-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one; N,N-dimethylformamide CAS Name: 5-(4-chlorophenyl)-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one; N,N-dimethylformamide IUPAC Name: 5-(4-chlorophenyl)-3-phenyl-2-sulfanylidene-1H-thieno[2,3-d]pyrimidin-4-one; N,N-dimethylformamide Traditional Name: 5-(4-chlorophenyl)-3-phenyl-2-thioxo-1H-thieno[2,3-d]pyrimidin-4-one; N,N-dimethylformamide Formula: C39H29Cl2N5O3S4 MolecularWeight: 814.84526

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=O.C1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC=C3C4=CC=C(C=C4)Cl.C1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC=C3C4=CC=C(C=C4)Cl

Isomeric SMILES

CN(C)C=O.C1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC=C3C4=CC=C(C=C4)Cl.C1=CC=C(C=C1)N2C(=O)C3=C(NC2=S)SC=C3C4=CC=C(C=C4)Cl

InChI

InChI=1S/2C18H11ClN2OS2.C3H7NO/c2*19-12-8-6-11(7-9-12)14-10-24-16-15(14)17(22)21(18(23)20-16)13-4-2-1-3-5-13;1-4(2)3-5/h2*1-10H,(H,20,23);3H,1-2H3