N-[1-[2-(4-methylsulfanyl-3-nitro-phenyl)carbonylphenyl]carbonylpiperidin-4-yl]thiophene-2-sulfonamide

Systemtic Name: N-[1-[2-(4-methylsulfanyl-3-nitro-phenyl)carbonylphenyl]carbonylpiperidin-4-yl]thiophene-2-sulfonamide Openeye Name: N-[1-[2-(4-methylsulfanyl-3-nitro-benzoyl)benzoyl]-4-piperidyl]thiophene-2-sulfonamide CAS Name: N-[1-[[2-[[4-(methylthio)-3-nitrophenyl]-oxomethyl]phenyl]-oxomethyl]-4-piperidinyl]-2-thiophenesulfonamide IUPAC Name: N-[1-[2-(4-methylsulfanyl-3-nitrobenzoyl)benzoyl]piperidin-4-yl]thiophene-2-sulfonamide Traditional Name: N-[1-[2-[4-(methylthio)-3-nitro-benzoyl]benzoyl]-4-piperidyl]thiophene-2-sulfonamide Formula: C24H23N3O6S3 MolecularWeight: 545.65092

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CS4)[N+](=O)[O-]

Isomeric SMILES

CSC1=C(C=C(C=C1)C(=O)C2=CC=CC=C2C(=O)N3CCC(CC3)NS(=O)(=O)C4=CC=CS4)[N+](=O)[O-]

InChI

InChI=1S/C24H23N3O6S3/c1-34-21-9-8-16(15-20(21)27(30)31)23(28)18-5-2-3-6-19(18)24(29)26-12-10-17(11-13-26)25-36(32,33)22-7-4-14-35-22/h2-9,14-15,17,25H,10-13H2,1H3