2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 2-[(6,7-dimethyl-2-oxo-chromen-4-yl)methylsulfanyl]-1H-pyrimidin-6-one CAS Name: 2-[(6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methylthio]-1H-pyrimidin-6-one IUPAC Name: 2-[(6,7-dimethyl-2-oxochromen-4-yl)methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 2-[(2-keto-6,7-dimethyl-chromen-4-yl)methylthio]-1H-pyrimidin-6-one Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC=CC(=O)N3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=NC=CC(=O)N3)C

InChI

InChI=1S/C16H14N2O3S/c1-9-5-12-11(7-15(20)21-13(12)6-10(9)2)8-22-16-17-4-3-14(19)18-16/h3-7H,8H2,1-2H3,(H,17,18,19)