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

Systemtic Name: 6-chloranyl-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 6-chloro-7-hydroxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one CAS Name: 6-chloro-7-hydroxy-4-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]-1-benzopyran-2-one IUPAC Name: 6-chloro-7-hydroxy-4-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]chromen-2-one Traditional Name: 6-chloro-7-hydroxy-4-[[methyl-[4-(methylthio)benzyl]amino]methyl]coumarin Formula: C19H18ClNO3S MolecularWeight: 375.86912

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CC2=CC(=O)OC3=CC(=C(C=C23)Cl)O

InChI

InChI=1S/C19H18ClNO3S/c1-21(10-12-3-5-14(25-2)6-4-12)11-13-7-19(23)24-18-9-17(22)16(20)8-15(13)18/h3-9,22H,10-11H2,1-2H3