5,7-bis(chloranyl)-3-(3,4-dihydro-2H-chromen-3-ylmethylsulfanyl)-2-oxidanyl-1H-quinolin-4-one

Systemtic Name: 5,7-bis(chloranyl)-3-(3,4-dihydro-2H-chromen-3-ylmethylsulfanyl)-2-oxidanyl-1H-quinolin-4-one Openeye Name: 5,7-dichloro-3-(chroman-3-ylmethylsulfanyl)-2-hydroxy-1H-quinolin-4-one CAS Name: 5,7-dichloro-3-(3,4-dihydro-2H-1-benzopyran-3-ylmethylthio)-2-hydroxy-1H-quinolin-4-one IUPAC Name: 5,7-dichloro-3-(3,4-dihydro-2H-chromen-3-ylmethylsulfanyl)-2-hydroxy-1H-quinolin-4-one Traditional Name: 5,7-dichloro-3-(chroman-3-ylmethylthio)-2-hydroxy-4-quinolone Formula: C19H15Cl2NO3S MolecularWeight: 408.2983

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=CC=CC=C21)CSC3=C(NC4=CC(=CC(=C4C3=O)Cl)Cl)O

Isomeric SMILES

C1C(COC2=CC=CC=C21)CSC3=C(NC4=CC(=CC(=C4C3=O)Cl)Cl)O

InChI

InChI=1S/C19H15Cl2NO3S/c20-12-6-13(21)16-14(7-12)22-19(24)18(17(16)23)26-9-10-5-11-3-1-2-4-15(11)25-8-10/h1-4,6-7,10H,5,8-9H2,(H2,22,23,24)