N-[(1S,2R)-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide

Systemtic Name: N-[(1S,2R)-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide Openeye Name: N-[(1S,2R)-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide CAS Name: N-[(1S,2R)-2-(1H-1,2,4-triazol-5-ylthio)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide IUPAC Name: N-[(1S,2R)-2-(1H-1,2,4-triazol-5-ylsulfanyl)-1,2-dihydroacenaphthylen-1-yl]benzenesulfonamide Traditional Name: N-[(1S,2R)-2-(1H-1,2,4-triazol-5-ylthio)acenaphthen-1-yl]benzenesulfonamide Formula: C20H16N4O2S2 MolecularWeight: 408.49664

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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=NC=NN5

Isomeric SMILES

C1=CC=C(C=C1)S(=O)(=O)N[C@@H]2[C@@H](C3=CC=CC4=C3C2=CC=C4)SC5=NC=NN5

InChI

InChI=1S/C20H16N4O2S2/c25-28(26,14-8-2-1-3-9-14)24-18-15-10-4-6-13-7-5-11-16(17(13)15)19(18)27-20-21-12-22-23-20/h1-12,18-19,24H,(H,21,22,23)/t18-,19+/m0/s1