3,6-bis(chloranyl)-4-(phenylmethylsulfanyl)chromen-2-one

Systemtic Name: 3,6-bis(chloranyl)-4-(phenylmethylsulfanyl)chromen-2-one Openeye Name: 4-benzylsulfanyl-3,6-dichloro-chromen-2-one CAS Name: 3,6-dichloro-4-(phenylmethylthio)-1-benzopyran-2-one IUPAC Name: 4-benzylsulfanyl-3,6-dichlorochromen-2-one Traditional Name: 4-(benzylthio)-3,6-dichloro-coumarin Formula: C16H10Cl2O2S MolecularWeight: 337.2204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=O)OC3=C2C=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=O)OC3=C2C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H10Cl2O2S/c17-11-6-7-13-12(8-11)15(14(18)16(19)20-13)21-9-10-4-2-1-3-5-10/h1-8H,9H2