4-[3-[(4-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]benzenesulfonamide

Systemtic Name: 4-[3-[(4-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]benzenesulfonamide Openeye Name: 4-[3-[(4-chloro-1,3-benzothiazol-2-yl)sulfanyl]-5-(2-thienyl)-1,2,4-triazol-4-yl]benzenesulfonamide CAS Name: 4-[3-[(4-chloro-1,3-benzothiazol-2-yl)thio]-5-thiophen-2-yl-1,2,4-triazol-4-yl]benzenesulfonamide IUPAC Name: 4-[3-[(4-chloro-1,3-benzothiazol-2-yl)sulfanyl]-5-thiophen-2-yl-1,2,4-triazol-4-yl]benzenesulfonamide Traditional Name: 4-[3-[(4-chloro-1,3-benzothiazol-2-yl)thio]-5-(2-thienyl)-1,2,4-triazol-4-yl]benzenesulfonamide Formula: C19H12ClN5O2S4 MolecularWeight: 506.04388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Cl)N=C(S2)SC3=NN=C(N3C4=CC=C(C=C4)S(=O)(=O)N)C5=CC=CS5

Isomeric SMILES

C1=CC2=C(C(=C1)Cl)N=C(S2)SC3=NN=C(N3C4=CC=C(C=C4)S(=O)(=O)N)C5=CC=CS5

InChI

InChI=1S/C19H12ClN5O2S4/c20-13-3-1-4-14-16(13)22-19(29-14)30-18-24-23-17(15-5-2-10-28-15)25(18)11-6-8-12(9-7-11)31(21,26)27/h1-10H,(H2,21,26,27)