2-chloranyl-5-nitro-N-[3-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]propyl]benzenesulfonamide

Systemtic Name: 2-chloranyl-5-nitro-N-[3-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]propyl]benzenesulfonamide Openeye Name: 2-chloro-5-nitro-N-[3-(4-phenylthiazol-2-yl)sulfanylpropyl]benzenesulfonamide CAS Name: 2-chloro-5-nitro-N-[3-[(4-phenyl-2-thiazolyl)thio]propyl]benzenesulfonamide IUPAC Name: 2-chloro-5-nitro-N-[3-[(4-phenyl-1,3-thiazol-2-yl)sulfanyl]propyl]benzenesulfonamide Traditional Name: 2-chloro-5-nitro-N-[3-[(4-phenylthiazol-2-yl)thio]propyl]benzenesulfonamide Formula: C18H16ClN3O4S3 MolecularWeight: 469.98534

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC(=N2)SCCCNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC(=N2)SCCCNS(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C18H16ClN3O4S3/c19-15-8-7-14(22(23)24)11-17(15)29(25,26)20-9-4-10-27-18-21-16(12-28-18)13-5-2-1-3-6-13/h1-3,5-8,11-12,20H,4,9-10H2