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

Systemtic Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-2-oxidanylidene-3-propyl-1,3-benzothiazole-7-sulfonamide Openeye Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-2-oxo-3-propyl-1,3-benzothiazole-7-sulfonamide CAS Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-2-oxo-3-propyl-1,3-benzothiazole-7-sulfonamide IUPAC Name: N-[2-[(3-chlorophenyl)methylamino]ethyl]-2-oxo-3-propyl-1,3-benzothiazole-7-sulfonamide Traditional Name: N-[2-[(3-chlorobenzyl)amino]ethyl]-2-keto-3-propyl-1,3-benzothiazole-7-sulfonamide Formula: C19H22ClN3O3S2 MolecularWeight: 439.97928

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C(=CC=C2)S(=O)(=O)NCCNCC3=CC(=CC=C3)Cl)SC1=O

Isomeric SMILES

CCCN1C2=C(C(=CC=C2)S(=O)(=O)NCCNCC3=CC(=CC=C3)Cl)SC1=O

InChI

InChI=1S/C19H22ClN3O3S2/c1-2-11-23-16-7-4-8-17(18(16)27-19(23)24)28(25,26)22-10-9-21-13-14-5-3-6-15(20)12-14/h3-8,12,21-22H,2,9-11,13H2,1H3