1-cyclohexyl-6-oxidanyl-5-(3-oxidanylidene-1H-2-benzofuran-1-yl)-2-sulfanylidene-pyrimidin-4-one

Systemtic Name: 1-cyclohexyl-6-oxidanyl-5-(3-oxidanylidene-1H-2-benzofuran-1-yl)-2-sulfanylidene-pyrimidin-4-one Openeye Name: 1-cyclohexyl-6-hydroxy-5-(3-oxo-1H-isobenzofuran-1-yl)-2-thioxo-pyrimidin-4-one CAS Name: 1-cyclohexyl-6-hydroxy-5-(3-oxo-1H-isobenzofuran-1-yl)-2-sulfanylidene-4-pyrimidinone IUPAC Name: 1-cyclohexyl-6-hydroxy-5-(3-oxo-1H-2-benzofuran-1-yl)-2-sulfanylidenepyrimidin-4-one Traditional Name: 1-cyclohexyl-6-hydroxy-5-phthalidyl-2-thioxo-pyrimidin-4-one Formula: C18H18N2O4S MolecularWeight: 358.41152

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=C(C(=O)NC2=S)C3C4=CC=CC=C4C(=O)O3)O

Isomeric SMILES

C1CCC(CC1)N2C(=C(C(=O)NC2=S)C3C4=CC=CC=C4C(=O)O3)O

InChI

InChI=1S/C18H18N2O4S/c21-15-13(14-11-8-4-5-9-12(11)17(23)24-14)16(22)20(18(25)19-15)10-6-2-1-3-7-10/h4-5,8-10,14,22H,1-3,6-7H2,(H,19,21,25)