3-[(2-aminophenyl)sulfanyl-phenyl-methyl]-2-phenyl-2,3-dihydrochromen-4-one

Systemtic Name: 3-[(2-aminophenyl)sulfanyl-phenyl-methyl]-2-phenyl-2,3-dihydrochromen-4-one Openeye Name: 3-[(2-aminophenyl)sulfanyl-phenyl-methyl]-2-phenyl-chroman-4-one CAS Name: 3-[[(2-aminophenyl)thio]-phenylmethyl]-2-phenyl-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 3-[(2-aminophenyl)sulfanyl-phenylmethyl]-2-phenyl-2,3-dihydrochromen-4-one Traditional Name: 3-[[(2-aminophenyl)thio]-phenyl-methyl]-2-phenyl-chroman-4-one Formula: C28H23NO2S MolecularWeight: 437.55272

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2C(C(=O)C3=CC=CC=C3O2)C(C4=CC=CC=C4)SC5=CC=CC=C5N

Isomeric SMILES

C1=CC=C(C=C1)C2C(C(=O)C3=CC=CC=C3O2)C(C4=CC=CC=C4)SC5=CC=CC=C5N

InChI

InChI=1S/C28H23NO2S/c29-22-16-8-10-18-24(22)32-28(20-13-5-2-6-14-20)25-26(30)21-15-7-9-17-23(21)31-27(25)19-11-3-1-4-12-19/h1-18,25,27-28H,29H2