N-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-4-methyl-3-nitro-benzenesulfonamide

Systemtic Name: N-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-4-oxidanyl-naphthalen-1-yl]-4-methyl-3-nitro-benzenesulfonamide Openeye Name: N-[3-(4,5-dihydrothiazol-2-ylsulfanyl)-4-hydroxy-1-naphthyl]-4-methyl-3-nitro-benzenesulfonamide CAS Name: N-[3-(4,5-dihydrothiazol-2-ylthio)-4-hydroxy-1-naphthalenyl]-4-methyl-3-nitrobenzenesulfonamide IUPAC Name: N-[3-(4,5-dihydro-1,3-thiazol-2-ylsulfanyl)-4-hydroxynaphthalen-1-yl]-4-methyl-3-nitrobenzenesulfonamide Traditional Name: N-[4-hydroxy-3-(2-thiazolin-2-ylthio)-1-naphthyl]-4-methyl-3-nitro-benzenesulfonamide Formula: C20H17N3O5S3 MolecularWeight: 475.56108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NCCS4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC(=C(C3=CC=CC=C32)O)SC4=NCCS4)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O5S3/c1-12-6-7-13(10-17(12)23(25)26)31(27,28)22-16-11-18(30-20-21-8-9-29-20)19(24)15-5-3-2-4-14(15)16/h2-7,10-11,22,24H,8-9H2,1H3