N-[2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]-4-methyl-benzenesulfonamide CAS Name: N-[2-(1,3-benzoxazol-2-ylthio)-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]-4-methylbenzenesulfonamide Traditional Name: N-[2-(1,3-benzoxazol-2-ylthio)acenaphthen-1-yl]-4-methyl-benzenesulfonamide Formula: C26H20N2O3S2 MolecularWeight: 472.5786

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NC6=CC=CC=C6O5

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2C(C3=CC=CC4=C3C2=CC=C4)SC5=NC6=CC=CC=C6O5

InChI

InChI=1S/C26H20N2O3S2/c1-16-12-14-18(15-13-16)33(29,30)28-24-19-8-4-6-17-7-5-9-20(23(17)19)25(24)32-26-27-21-10-2-3-11-22(21)31-26/h2-15,24-25,28H,1H3