3-[1-(4-chlorophenyl)-2-prop-2-enylsulfanyl-imidazol-4-yl]chromen-2-one

Systemtic Name: 3-[1-(4-chlorophenyl)-2-prop-2-enylsulfanyl-imidazol-4-yl]chromen-2-one Openeye Name: 3-[2-allylsulfanyl-1-(4-chlorophenyl)imidazol-4-yl]chromen-2-one CAS Name: 3-[1-(4-chlorophenyl)-2-(prop-2-enylthio)-4-imidazolyl]-1-benzopyran-2-one IUPAC Name: 3-[1-(4-chlorophenyl)-2-prop-2-enylsulfanylimidazol-4-yl]chromen-2-one Traditional Name: 3-[2-(allylthio)-1-(4-chlorophenyl)imidazol-4-yl]coumarin Formula: C21H15ClN2O2S MolecularWeight: 394.874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=NC(=CN1C2=CC=C(C=C2)Cl)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

C=CCSC1=NC(=CN1C2=CC=C(C=C2)Cl)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C21H15ClN2O2S/c1-2-11-27-21-23-18(13-24(21)16-9-7-15(22)8-10-16)17-12-14-5-3-4-6-19(14)26-20(17)25/h2-10,12-13H,1,11H2