7-methoxy-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one

Systemtic Name: 7-methoxy-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one Openeye Name: 7-methoxy-4-(2-pyridylsulfanylmethyl)chromen-2-one CAS Name: 7-methoxy-4-[(2-pyridinylthio)methyl]-1-benzopyran-2-one IUPAC Name: 7-methoxy-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one Traditional Name: 7-methoxy-4-[(2-pyridylthio)methyl]coumarin Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13NO3S/c1-19-12-5-6-13-11(8-16(18)20-14(13)9-12)10-21-15-4-2-3-7-17-15/h2-9H,10H2,1H3