N-[2-[(3-chlorophenyl)methylamino]ethyl]-N-methyl-2-oxidanylidene-3H-1,3-benzothiazole-7-sulfonamide

Systemtic Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-N-methyl-2-oxidanylidene-3H-1,3-benzothiazole-7-sulfonamide Openeye Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-N-methyl-2-oxo-3H-1,3-benzothiazole-7-sulfonamide CAS Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-N-methyl-2-oxo-3H-1,3-benzothiazole-7-sulfonamide IUPAC Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-N-methyl-2-oxo-3H-1,3-benzothiazole-7-sulfonamide Traditional Name: N-[2-[(3-chlorobenzyl)amino]ethyl]-2-keto-N-methyl-3H-1,3-benzothiazole-7-sulfonamide Formula: C17H18ClN3O3S2 MolecularWeight: 411.92612

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCNCC1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC3=C2SC(=O)N3

Isomeric SMILES

CN(CCNCC1=CC(=CC=C1)Cl)S(=O)(=O)C2=CC=CC3=C2SC(=O)N3

InChI

InChI=1S/C17H18ClN3O3S2/c1-21(9-8-19-11-12-4-2-5-13(18)10-12)26(23,24)15-7-3-6-14-16(15)25-17(22)20-14/h2-7,10,19H,8-9,11H2,1H3,(H,20,22)