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

Systemtic Name: ethyl 3-(furan-2-ylmethylidene)-2-oxidanylidene-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate Openeye Name: ethyl 3-(2-furylmethylene)-2-oxo-7-phenyl-4-thioxo-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate CAS Name: 3-(2-furanylmethylidene)-2-oxo-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylic acid ethyl ester IUPAC Name: ethyl 3-(furan-2-ylmethylidene)-2-oxo-7-phenyl-4-sulfanylidene-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylate Traditional Name: 3-(2-furfurylidene)-2-keto-7-phenyl-4-thioxo-1H-pyrrolo[1,2-a]pyrimidine-8-carboxylic acid ethyl ester Formula: C21H16N2O4S MolecularWeight: 392.42774

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2NC(=O)C(=CC3=CC=CO3)C(=S)N2C=C1C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C2NC(=O)C(=CC3=CC=CO3)C(=S)N2C=C1C4=CC=CC=C4

InChI

InChI=1S/C21H16N2O4S/c1-2-26-21(25)17-16(13-7-4-3-5-8-13)12-23-18(17)22-19(24)15(20(23)28)11-14-9-6-10-27-14/h3-12H,2H2,1H3,(H,22,24)