4-[[2-(4-chlorophenyl)sulfanylethylamino]methyl]-8-methyl-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[2-(4-chlorophenyl)sulfanylethylamino]methyl]-8-methyl-7-oxidanyl-chromen-2-one Openeye Name: 4-[[2-(4-chlorophenyl)sulfanylethylamino]methyl]-7-hydroxy-8-methyl-chromen-2-one CAS Name: 4-[[2-[(4-chlorophenyl)thio]ethylamino]methyl]-7-hydroxy-8-methyl-1-benzopyran-2-one IUPAC Name: 4-[[2-(4-chlorophenyl)sulfanylethylamino]methyl]-7-hydroxy-8-methylchromen-2-one Traditional Name: 4-[[2-[(4-chlorophenyl)thio]ethylamino]methyl]-7-hydroxy-8-methyl-coumarin Formula: C19H18ClNO3S MolecularWeight: 375.86912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CNCCSC3=CC=C(C=C3)Cl)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CNCCSC3=CC=C(C=C3)Cl)O

InChI

InChI=1S/C19H18ClNO3S/c1-12-17(22)7-6-16-13(10-18(23)24-19(12)16)11-21-8-9-25-15-4-2-14(20)3-5-15/h2-7,10,21-22H,8-9,11H2,1H3