3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-methyl-1,3-benzothiazol-2-yl)propionamide Formula: C19H21N3O3S2 MolecularWeight: 403.51834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C19H21N3O3S2/c1-12-5-7-15-16(10-12)26-19(21-15)22-18(23)8-9-20-27(24,25)17-11-13(2)4-6-14(17)3/h4-7,10-11,20H,8-9H2,1-3H3,(H,21,22,23)