2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-6-one

Systemtic Name: 2-[(3-oxidanylidenebenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-6-one Openeye Name: 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-6-one CAS Name: 2-[(3-oxo-1-benzo[f][1]benzopyranyl)methylthio]-1H-pyrimidin-6-one IUPAC Name: 2-[(3-oxobenzo[f]chromen-1-yl)methylsulfanyl]-1H-pyrimidin-6-one Traditional Name: 2-[(3-ketobenzo[f]chromen-1-yl)methylthio]-1H-pyrimidin-6-one Formula: C18H12N2O3S MolecularWeight: 336.36448

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)CSC4=NC=CC(=O)N4

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(=CC(=O)O3)CSC4=NC=CC(=O)N4

InChI

InChI=1S/C18H12N2O3S/c21-15-7-8-19-18(20-15)24-10-12-9-16(22)23-14-6-5-11-3-1-2-4-13(11)17(12)14/h1-9H,10H2,(H,19,20,21)