4-[[4-azanyl-5-(5-nitro-1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]amino]benzenesulfonamide

Systemtic Name: 4-[[4-azanyl-5-(5-nitro-1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]amino]benzenesulfonamide Openeye Name: 4-[[4-amino-5-(5-nitro-1,3-benzothiazol-2-yl)thiazol-2-yl]amino]benzenesulfonamide CAS Name: 4-[[4-amino-5-(5-nitro-1,3-benzothiazol-2-yl)-2-thiazolyl]amino]benzenesulfonamide IUPAC Name: 4-[[4-amino-5-(5-nitro-1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]amino]benzenesulfonamide Traditional Name: 4-[[4-amino-5-(5-nitro-1,3-benzothiazol-2-yl)thiazol-2-yl]amino]benzenesulfonamide Formula: C16H12N6O4S3 MolecularWeight: 448.49928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=NC(=C(S2)C3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-])N)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1NC2=NC(=C(S2)C3=NC4=C(S3)C=CC(=C4)[N+](=O)[O-])N)S(=O)(=O)N

InChI

InChI=1S/C16H12N6O4S3/c17-14-13(15-20-11-7-9(22(23)24)3-6-12(11)27-15)28-16(21-14)19-8-1-4-10(5-2-8)29(18,25)26/h1-7H,17H2,(H,19,21)(H2,18,25,26)