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

Systemtic Name: 6-azanyl-2-[(7-methoxy-2-oxidanylidene-chromen-4-yl)methylsulfanyl]-1H-pyrimidin-4-one Openeye Name: 6-amino-2-[(7-methoxy-2-oxo-chromen-4-yl)methylsulfanyl]-1H-pyrimidin-4-one CAS Name: 6-amino-2-[(7-methoxy-2-oxo-1-benzopyran-4-yl)methylthio]-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-[(7-methoxy-2-oxochromen-4-yl)methylsulfanyl]-1H-pyrimidin-4-one Traditional Name: 6-amino-2-[(2-keto-7-methoxy-chromen-4-yl)methylthio]-1H-pyrimidin-4-one Formula: C15H13N3O4S MolecularWeight: 331.34642

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=O)C=C(N3)N

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CSC3=NC(=O)C=C(N3)N

InChI

InChI=1S/C15H13N3O4S/c1-21-9-2-3-10-8(4-14(20)22-11(10)5-9)7-23-15-17-12(16)6-13(19)18-15/h2-6H,7H2,1H3,(H3,16,17,18,19)