4-[(6-methylpyridin-2-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[(6-methylpyridin-2-yl)sulfanylmethyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(6-methyl-2-pyridyl)sulfanylmethyl]chromen-2-one CAS Name: 7-hydroxy-4-[[(6-methyl-2-pyridinyl)thio]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(6-methylpyridin-2-yl)sulfanylmethyl]chromen-2-one Traditional Name: 7-hydroxy-4-[[(6-methyl-2-pyridyl)thio]methyl]coumarin Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)SCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CC1=NC(=CC=C1)SCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

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