4-[1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]benzenesulfonamide Openeye Name: 4-[1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]benzenesulfonamide CAS Name: 4-[1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]benzenesulfonamide IUPAC Name: 4-[1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]benzenesulfonamide Traditional Name: 4-[1-[1,3-benzothiazol-2-ylmethyl(methyl)amino]ethyl]benzenesulfonamide Formula: C17H19N3O2S2 MolecularWeight: 361.48166

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)N)N(C)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)N)N(C)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H19N3O2S2/c1-12(13-7-9-14(10-8-13)24(18,21)22)20(2)11-17-19-15-5-3-4-6-16(15)23-17/h3-10,12H,11H2,1-2H3,(H2,18,21,22)