4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide

Systemtic Name: 4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]-3-nitro-benzenesulfonamide Openeye Name: 3-nitro-4-[4-(p-tolyl)thiazol-2-yl]sulfanyl-benzenesulfonamide CAS Name: 4-[[4-(4-methylphenyl)-2-thiazolyl]thio]-3-nitrobenzenesulfonamide IUPAC Name: 4-[[4-(4-methylphenyl)-1,3-thiazol-2-yl]sulfanyl]-3-nitrobenzenesulfonamide Traditional Name: 3-nitro-4-[[4-(p-tolyl)thiazol-2-yl]thio]benzenesulfonamide Formula: C16H13N3O4S3 MolecularWeight: 407.48712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC(=N2)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC(=N2)SC3=C(C=C(C=C3)S(=O)(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C16H13N3O4S3/c1-10-2-4-11(5-3-10)13-9-24-16(18-13)25-15-7-6-12(26(17,22)23)8-14(15)19(20)21/h2-9H,1H3,(H2,17,22,23)