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

Systemtic Name: 3-[(3,4-dichlorophenyl)methyl]thiochromen-4-one Openeye Name: 3-[(3,4-dichlorophenyl)methyl]thiochromen-4-one CAS Name: 3-[(3,4-dichlorophenyl)methyl]-1-benzothiopyran-4-one IUPAC Name: 3-[(3,4-dichlorophenyl)methyl]thiochromen-4-one Traditional Name: 3-(3,4-dichlorobenzyl)thiochromen-4-one Formula: C16H10Cl2OS MolecularWeight: 321.221

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CS2)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CS2)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H10Cl2OS/c17-13-6-5-10(8-14(13)18)7-11-9-20-15-4-2-1-3-12(15)16(11)19/h1-6,8-9H,7H2