4-[[(4,5-dimethyl-6-oxidanyl-7-propan-2-yl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[(4,5-dimethyl-6-oxidanyl-7-propan-2-yl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide Openeye Name: 4-[[(6-hydroxy-7-isopropyl-4,5-dimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide CAS Name: 4-[[(6-hydroxy-4,5-dimethyl-7-propan-2-yl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide IUPAC Name: 4-[[(6-hydroxy-4,5-dimethyl-7-propan-2-yl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide Traditional Name: 4-[[(6-hydroxy-7-isopropyl-4,5-dimethyl-1,3-benzothiazol-2-yl)amino]methyl]benzenesulfonamide Formula: C19H23N3O3S2 MolecularWeight: 405.53422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1N=C(S2)NCC3=CC=C(C=C3)S(=O)(=O)N)C(C)C)O)C

Isomeric SMILES

CC1=C(C(=C(C2=C1N=C(S2)NCC3=CC=C(C=C3)S(=O)(=O)N)C(C)C)O)C

InChI

InChI=1S/C19H23N3O3S2/c1-10(2)15-17(23)12(4)11(3)16-18(15)26-19(22-16)21-9-13-5-7-14(8-6-13)27(20,24)25/h5-8,10,23H,9H2,1-4H3,(H,21,22)(H2,20,24,25)