3-[(3,4-dichlorophenyl)methyl]-2-phenyl-thiochromen-4-one

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenyl-thiochromen-4-one Openeye Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenyl-thiochromen-4-one CAS Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenyl-1-benzothiopyran-4-one IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]-2-phenylthiochromen-4-one Traditional Name: 3-(3,4-dichlorobenzyl)-2-phenyl-thiochromen-4-one Formula: C22H14Cl2OS MolecularWeight: 397.31696

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3S2)CC4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C(C(=O)C3=CC=CC=C3S2)CC4=CC(=C(C=C4)Cl)Cl

InChI

InChI=1S/C22H14Cl2OS/c23-18-11-10-14(13-19(18)24)12-17-21(25)16-8-4-5-9-20(16)26-22(17)15-6-2-1-3-7-15/h1-11,13H,12H2