3-[1-(4-bromophenyl)-2-(phenylmethylsulfanyl)imidazol-4-yl]chromen-2-one

Systemtic Name: 3-[1-(4-bromophenyl)-2-(phenylmethylsulfanyl)imidazol-4-yl]chromen-2-one Openeye Name: 3-[2-benzylsulfanyl-1-(4-bromophenyl)imidazol-4-yl]chromen-2-one CAS Name: 3-[1-(4-bromophenyl)-2-(phenylmethylthio)-4-imidazolyl]-1-benzopyran-2-one IUPAC Name: 3-[2-benzylsulfanyl-1-(4-bromophenyl)imidazol-4-yl]chromen-2-one Traditional Name: 3-[2-(benzylthio)-1-(4-bromophenyl)imidazol-4-yl]coumarin Formula: C25H17BrN2O2S MolecularWeight: 489.38368

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NC(=CN2C3=CC=C(C=C3)Br)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NC(=CN2C3=CC=C(C=C3)Br)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C25H17BrN2O2S/c26-19-10-12-20(13-11-19)28-15-22(27-25(28)31-16-17-6-2-1-3-7-17)21-14-18-8-4-5-9-23(18)30-24(21)29/h1-15H,16H2