3,7-dimethyl-3-(4-methylphenyl)-2H-thiochromen-4-one

Systemtic Name: 3,7-dimethyl-3-(4-methylphenyl)-2H-thiochromen-4-one Openeye Name: 3,7-dimethyl-3-(p-tolyl)thiochroman-4-one CAS Name: 3,7-dimethyl-3-(4-methylphenyl)-2H-1-benzothiopyran-4-one IUPAC Name: 3,7-dimethyl-3-(4-methylphenyl)-2H-thiochromen-4-one Traditional Name: 3,7-dimethyl-3-(p-tolyl)thiochroman-4-one Formula: C18H18OS MolecularWeight: 282.39992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2(CSC3=C(C2=O)C=CC(=C3)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2(CSC3=C(C2=O)C=CC(=C3)C)C

InChI

InChI=1S/C18H18OS/c1-12-4-7-14(8-5-12)18(3)11-20-16-10-13(2)6-9-15(16)17(18)19/h4-10H,11H2,1-3H3