(6-ethanoyl-4-oxidanylidene-1,3-diphenyl-2-sulfanylidene-thieno[2,3-d]pyrimidin-5-yl) 4-chloranylbenzoate

Systemtic Name: (6-ethanoyl-4-oxidanylidene-1,3-diphenyl-2-sulfanylidene-thieno[2,3-d]pyrimidin-5-yl) 4-chloranylbenzoate Openeye Name: (6-acetyl-4-oxo-1,3-diphenyl-2-thioxo-thieno[2,3-d]pyrimidin-5-yl) 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid (6-acetyl-4-oxo-1,3-diphenyl-2-sulfanylidene-5-thieno[2,3-d]pyrimidinyl) ester IUPAC Name: (6-acetyl-4-oxo-1,3-diphenyl-2-sulfanylidenethieno[2,3-d]pyrimidin-5-yl) 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid (6-acetyl-4-keto-1,3-diphenyl-2-thioxo-thieno[2,3-d]pyrimidin-5-yl) ester Formula: C27H17ClN2O4S2 MolecularWeight: 533.01788

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C2=C(S1)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC(=O)C1=C(C2=C(S1)N(C(=S)N(C2=O)C3=CC=CC=C3)C4=CC=CC=C4)OC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C27H17ClN2O4S2/c1-16(31)23-22(34-26(33)17-12-14-18(28)15-13-17)21-24(32)29(19-8-4-2-5-9-19)27(35)30(25(21)36-23)20-10-6-3-7-11-20/h2-15H,1H3