4-[[5-(quinolin-8-ylsulfonylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[5-(quinolin-8-ylsulfonylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[5-(8-quinolylsulfonylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzamidine hydrochloride CAS Name: 4-[[[5-(8-quinolinylsulfonylamino)-1,3-benzothiazol-2-yl]thio]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[5-(quinolin-8-ylsulfonylamino)-1,3-benzothiazol-2-yl]sulfanylmethyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[[5-(8-quinolylsulfonylamino)-1,3-benzothiazol-2-yl]thio]methyl]benzamidine hydrochloride Formula: C24H20ClN5O2S3 MolecularWeight: 542.0959

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)S(=O)(=O)NC3=CC4=C(C=C3)SC(=N4)SCC5=CC=C(C=C5)C(=N)N)N=CC=C2.Cl

Isomeric SMILES

C1=CC2=C(C(=C1)S(=O)(=O)NC3=CC4=C(C=C3)SC(=N4)SCC5=CC=C(C=C5)C(=N)N)N=CC=C2.Cl

InChI

InChI=1S/C24H19N5O2S3.ClH/c25-23(26)17-8-6-15(7-9-17)14-32-24-28-19-13-18(10-11-20(19)33-24)29-34(30,31)21-5-1-3-16-4-2-12-27-22(16)21;/h1-13,29H,14H2,(H3,25,26);1H