N-(1,3-benzothiazol-2-yl)-3-[(3-ethanoylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-[(3-ethanoylphenyl)sulfonylamino]propanamide Openeye Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-yl)propanamide CAS Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-yl)propanamide IUPAC Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-yl)propanamide Traditional Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-yl)propionamide Formula: C18H17N3O4S2 MolecularWeight: 403.47528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NCCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NCCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H17N3O4S2/c1-12(22)13-5-4-6-14(11-13)27(24,25)19-10-9-17(23)21-18-20-15-7-2-3-8-16(15)26-18/h2-8,11,19H,9-10H2,1H3,(H,20,21,23)