N-[(1S,2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide

Systemtic Name: N-[(1S,2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide Openeye Name: N-[(1S,2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide CAS Name: N-[(1S,2R)-2-(1,3-benzoxazol-2-ylthio)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide IUPAC Name: N-[(1S,2R)-2-(1,3-benzoxazol-2-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide Traditional Name: N-[(1S,2R)-2-(1,3-benzoxazol-2-ylthio)acenaphthen-1-yl]benzenesulfonamide Formula: C25H18N2O3S2 MolecularWeight: 458.55202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N[C@@H]2[C@@H](C3=CC=CC4=C3C2=CC=C4)SC5=NC6=CC=CC=C6O5

InChI

InChI=1S/C25H18N2O3S2/c28-32(29,17-10-2-1-3-11-17)27-23-18-12-6-8-16-9-7-13-19(22(16)18)24(23)31-25-26-20-14-4-5-15-21(20)30-25/h1-15,23-24,27H/t23-,24+/m0/s1