4-methyl-7-(2-methyl-3-oxidanylidene-butyl)sulfanyl-chromen-2-one

Systemtic Name: 4-methyl-7-(2-methyl-3-oxidanylidene-butyl)sulfanyl-chromen-2-one Openeye Name: 4-methyl-7-(2-methyl-3-oxo-butyl)sulfanyl-chromen-2-one CAS Name: 4-methyl-7-[(2-methyl-3-oxobutyl)thio]-1-benzopyran-2-one IUPAC Name: 4-methyl-7-(2-methyl-3-oxobutyl)sulfanylchromen-2-one Traditional Name: 7-[(3-keto-2-methyl-butyl)thio]-4-methyl-coumarin Formula: C15H16O3S MolecularWeight: 276.35074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)SCC(C)C(=O)C

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)SCC(C)C(=O)C

InChI

InChI=1S/C15H16O3S/c1-9-6-15(17)18-14-7-12(4-5-13(9)14)19-8-10(2)11(3)16/h4-7,10H,8H2,1-3H3