4-[[3-(1,3-benzothiazol-2-yl)-5-ethanoyl-1,2,4-triazol-4-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[3-(1,3-benzothiazol-2-yl)-5-ethanoyl-1,2,4-triazol-4-yl]amino]benzenesulfonamide Openeye Name: 4-[[3-acetyl-5-(1,3-benzothiazol-2-yl)-1,2,4-triazol-4-yl]amino]benzenesulfonamide CAS Name: 4-[[3-acetyl-5-(1,3-benzothiazol-2-yl)-1,2,4-triazol-4-yl]amino]benzenesulfonamide IUPAC Name: 4-[[3-acetyl-5-(1,3-benzothiazol-2-yl)-1,2,4-triazol-4-yl]amino]benzenesulfonamide Traditional Name: 4-[[3-acetyl-5-(1,3-benzothiazol-2-yl)-1,2,4-triazol-4-yl]amino]benzenesulfonamide Formula: C17H14N6O3S2 MolecularWeight: 414.46146

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=NN=C(N1NC2=CC=C(C=C2)S(=O)(=O)N)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(=O)C1=NN=C(N1NC2=CC=C(C=C2)S(=O)(=O)N)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H14N6O3S2/c1-10(24)15-20-21-16(17-19-13-4-2-3-5-14(13)27-17)23(15)22-11-6-8-12(9-7-11)28(18,25)26/h2-9,22H,1H3,(H2,18,25,26)