6-ethyl-7-oxidanyl-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one

Systemtic Name: 6-ethyl-7-oxidanyl-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one Openeye Name: 6-ethyl-7-hydroxy-4-(2-pyridylsulfanylmethyl)chromen-2-one CAS Name: 6-ethyl-7-hydroxy-4-[(2-pyridinylthio)methyl]-1-benzopyran-2-one IUPAC Name: 6-ethyl-7-hydroxy-4-(pyridin-2-ylsulfanylmethyl)chromen-2-one Traditional Name: 6-ethyl-7-hydroxy-4-[(2-pyridylthio)methyl]coumarin Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=CC=CC=N3)O

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=CC(=O)O2)CSC3=CC=CC=N3)O

InChI

InChI=1S/C17H15NO3S/c1-2-11-7-13-12(10-22-16-5-3-4-6-18-16)8-17(20)21-15(13)9-14(11)19/h3-9,19H,2,10H2,1H3