5-[(4-chlorophenyl)methyl]-6-[(2-oxidanylidene-5-phenyl-furan-3-ylidene)methyl]-2-sulfanylidene-1H-pyrimidin-4-one

Systemtic Name: 5-[(4-chlorophenyl)methyl]-6-[(2-oxidanylidene-5-phenyl-furan-3-ylidene)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Openeye Name: 5-[(4-chlorophenyl)methyl]-6-[(2-oxo-5-phenyl-3-furylidene)methyl]-2-thioxo-1H-pyrimidin-4-one CAS Name: 5-[(4-chlorophenyl)methyl]-6-[(2-oxo-5-phenyl-3-furanylidene)methyl]-2-sulfanylidene-1H-pyrimidin-4-one IUPAC Name: 5-[(4-chlorophenyl)methyl]-6-[(2-oxo-5-phenylfuran-3-ylidene)methyl]-2-sulfanylidene-1H-pyrimidin-4-one Traditional Name: 5-(4-chlorobenzyl)-6-[(2-keto-5-phenyl-3-furylidene)methyl]-2-thioxo-1H-pyrimidin-4-one Formula: C22H15ClN2O3S MolecularWeight: 422.8841

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=CC3=C(C(=O)NC(=S)N3)CC4=CC=C(C=C4)Cl)C(=O)O2

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=CC3=C(C(=O)NC(=S)N3)CC4=CC=C(C=C4)Cl)C(=O)O2

InChI

InChI=1S/C22H15ClN2O3S/c23-16-8-6-13(7-9-16)10-17-18(24-22(29)25-20(17)26)11-15-12-19(28-21(15)27)14-4-2-1-3-5-14/h1-9,11-12H,10H2,(H2,24,25,26,29)