3-[3-(3,5-dimethylphenyl)-2-sulfanylidene-1H-imidazol-5-yl]chromen-2-one

Systemtic Name: 3-[3-(3,5-dimethylphenyl)-2-sulfanylidene-1H-imidazol-5-yl]chromen-2-one Openeye Name: 3-[3-(3,5-dimethylphenyl)-2-thioxo-1H-imidazol-5-yl]chromen-2-one CAS Name: 3-[3-(3,5-dimethylphenyl)-2-sulfanylidene-1H-imidazol-5-yl]-1-benzopyran-2-one IUPAC Name: 3-[3-(3,5-dimethylphenyl)-2-sulfanylidene-1H-imidazol-5-yl]chromen-2-one Traditional Name: 3-[1-(3,5-dimethylphenyl)-2-thioxo-4-imidazolin-4-yl]coumarin Formula: C20H16N2O2S MolecularWeight: 348.41824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C=C(NC2=S)C3=CC4=CC=CC=C4OC3=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C=C(NC2=S)C3=CC4=CC=CC=C4OC3=O)C

InChI

InChI=1S/C20H16N2O2S/c1-12-7-13(2)9-15(8-12)22-11-17(21-20(22)25)16-10-14-5-3-4-6-18(14)24-19(16)23/h3-11H,1-2H3,(H,21,25)