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

Systemtic Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Openeye Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(2,5-dimethylphenyl)sulfonylamino]-N-(6-ethoxy-1,3-benzothiazol-2-yl)propionamide Formula: C20H23N3O4S2 MolecularWeight: 433.54432

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=C(C=CC(=C3)C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)CCNS(=O)(=O)C3=C(C=CC(=C3)C)C

InChI

InChI=1S/C20H23N3O4S2/c1-4-27-15-7-8-16-17(12-15)28-20(22-16)23-19(24)9-10-21-29(25,26)18-11-13(2)5-6-14(18)3/h5-8,11-12,21H,4,9-10H2,1-3H3,(H,22,23,24)