2-[(2,5-dimethylphenyl)sulfonylamino]-N-propan-2-yl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-propan-2-yl-1,3-benzothiazole-6-sulfonamide Openeye Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-isopropyl-1,3-benzothiazole-6-sulfonamide CAS Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-propan-2-yl-1,3-benzothiazole-6-sulfonamide IUPAC Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-propan-2-yl-1,3-benzothiazole-6-sulfonamide Traditional Name: 2-[(2,5-dimethylphenyl)sulfonylamino]-N-isopropyl-1,3-benzothiazole-6-sulfonamide Formula: C18H21N3O4S3 MolecularWeight: 439.57204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)NC(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)NC(C)C

InChI

InChI=1S/C18H21N3O4S3/c1-11(2)20-27(22,23)14-7-8-15-16(10-14)26-18(19-15)21-28(24,25)17-9-12(3)5-6-13(17)4/h5-11,20H,1-4H3,(H,19,21)