N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethanoylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzothiazol-2-ylmethyl)-3-[(4-ethanoylphenyl)sulfonylamino]propanamide Openeye Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-ylmethyl)propanamide CAS Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-ylmethyl)propanamide IUPAC Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-ylmethyl)propanamide Traditional Name: 3-[(4-acetylphenyl)sulfonylamino]-N-(1,3-benzothiazol-2-ylmethyl)propionamide Formula: C19H19N3O4S2 MolecularWeight: 417.50186

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H19N3O4S2/c1-13(23)14-6-8-15(9-7-14)28(25,26)21-11-10-18(24)20-12-19-22-16-4-2-3-5-17(16)27-19/h2-9,21H,10-12H2,1H3,(H,20,24)