2-(1-azanylethyl)-4-[1-(3-chlorophenyl)ethyl]-1,3-benzothiazole-7-sulfonamide

Systemtic Name: 2-(1-azanylethyl)-4-[1-(3-chlorophenyl)ethyl]-1,3-benzothiazole-7-sulfonamide Openeye Name: 2-(1-aminoethyl)-4-[1-(3-chlorophenyl)ethyl]-1,3-benzothiazole-7-sulfonamide CAS Name: 2-(1-aminoethyl)-4-[1-(3-chlorophenyl)ethyl]-1,3-benzothiazole-7-sulfonamide IUPAC Name: 2-(1-aminoethyl)-4-[1-(3-chlorophenyl)ethyl]-1,3-benzothiazole-7-sulfonamide Traditional Name: 2-(1-aminoethyl)-4-[1-(3-chlorophenyl)ethyl]-1,3-benzothiazole-7-sulfonamide Formula: C17H18ClN3O2S2 MolecularWeight: 395.92672

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)Cl)C2=C3C(=C(C=C2)S(=O)(=O)N)SC(=N3)C(C)N

Isomeric SMILES

CC(C1=CC(=CC=C1)Cl)C2=C3C(=C(C=C2)S(=O)(=O)N)SC(=N3)C(C)N

InChI

InChI=1S/C17H18ClN3O2S2/c1-9(11-4-3-5-12(18)8-11)13-6-7-14(25(20,22)23)16-15(13)21-17(24-16)10(2)19/h3-10H,19H2,1-2H3,(H2,20,22,23)