ethyl 3-[(2,4-dichlorophenyl)methylidene]-2-oxidanylidene-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate

Systemtic Name: ethyl 3-[(2,4-dichlorophenyl)methylidene]-2-oxidanylidene-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate Openeye Name: ethyl 3-[(2,4-dichlorophenyl)methylene]-2-oxo-7-phenyl-4-thioxo-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate CAS Name: 3-[(2,4-dichlorophenyl)methylidene]-2-oxo-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2,4-dichlorophenyl)methylidene]-2-oxo-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate Traditional Name: 3-(2,4-dichlorobenzylidene)-2-keto-7-phenyl-4-thioxo-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylic acid ethyl ester Formula: C23H16Cl2N2O3S MolecularWeight: 471.35574

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2NC(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)C(=S)N2C=C1C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2NC(=O)C(=CC3=C(C=C(C=C3)Cl)Cl)C(=S)N2C=C1C4=CC=CC=C4

InChI

InChI=1S/C23H16Cl2N2O3S/c1-2-30-23(29)19-17(13-6-4-3-5-7-13)12-27-20(19)26-21(28)16(22(27)31)10-14-8-9-15(24)11-18(14)25/h3-12H,2H2,1H3,(H,26,28)