4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]-7-methyl-6-propan-2-yl-chromen-2-one

Systemtic Name: 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]-7-methyl-6-propan-2-yl-chromen-2-one Openeye Name: 4-[(4,8-dimethyl-2-quinolyl)sulfanylmethyl]-6-isopropyl-7-methyl-chromen-2-one CAS Name: 4-[[(4,8-dimethyl-2-quinolinyl)thio]methyl]-7-methyl-6-propan-2-yl-1-benzopyran-2-one IUPAC Name: 4-[(4,8-dimethylquinolin-2-yl)sulfanylmethyl]-7-methyl-6-propan-2-ylchromen-2-one Traditional Name: 4-[[(4,8-dimethyl-2-quinolyl)thio]methyl]-6-isopropyl-7-methyl-coumarin Formula: C25H25NO2S MolecularWeight: 403.5365

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC2=C1N=C(C=C2C)SCC3=CC(=O)OC4=CC(=C(C=C34)C(C)C)C

Isomeric SMILES

CC1=CC=CC2=C1N=C(C=C2C)SCC3=CC(=O)OC4=CC(=C(C=C34)C(C)C)C

InChI

InChI=1S/C25H25NO2S/c1-14(2)20-12-21-18(11-24(27)28-22(21)9-16(20)4)13-29-23-10-17(5)19-8-6-7-15(3)25(19)26-23/h6-12,14H,13H2,1-5H3