4-methyl-7-(2-sulfanylethylamino)chromen-2-one

Systemtic Name: 4-methyl-7-(2-sulfanylethylamino)chromen-2-one Openeye Name: 4-methyl-7-(2-sulfanylethylamino)chromen-2-one CAS Name: 7-(2-mercaptoethylamino)-4-methyl-1-benzopyran-2-one IUPAC Name: 4-methyl-7-(2-sulfanylethylamino)chromen-2-one Traditional Name: 7-(2-mercaptoethylamino)-4-methyl-coumarin Formula: C12H13NO2S MolecularWeight: 235.30212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)NCCS

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)NCCS

InChI

InChI=1S/C12H13NO2S/c1-8-6-12(14)15-11-7-9(13-4-5-16)2-3-10(8)11/h2-3,6-7,13,16H,4-5H2,1H3