4-[[(3-methylsulfanylphenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(3-methylsulfanylphenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(3-methylsulfanylanilino)methyl]chromen-2-one CAS Name: 7-hydroxy-4-[[3-(methylthio)anilino]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(3-methylsulfanylanilino)methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[[3-(methylthio)anilino]methyl]coumarin Formula: C17H15NO3S MolecularWeight: 313.3709

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CSC1=CC=CC(=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C17H15NO3S/c1-22-14-4-2-3-12(8-14)18-10-11-7-17(20)21-16-9-13(19)5-6-15(11)16/h2-9,18-19H,10H2,1H3