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

Systemtic Name: 4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one CAS Name: 7-hydroxy-4-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one Traditional Name: 7-hydroxy-4-[[methyl-[4-(methylthio)benzyl]amino]methyl]coumarin Formula: C19H19NO3S MolecularWeight: 341.42406

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C19H19NO3S/c1-20(11-13-3-6-16(24-2)7-4-13)12-14-9-19(22)23-18-10-15(21)5-8-17(14)18/h3-10,21H,11-12H2,1-2H3