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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-[(2,5-dimethylphenyl)sulfonylamino]propanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-[(2,5-dimethylphenyl)sulfonylamino]propanamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-[(2,5-dimethylphenyl)sulfonylamino]propanamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-[(2,5-dimethylphenyl)sulfonylamino]propanamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-[(2,5-dimethylphenyl)sulfonylamino]propionamide Formula: C18H19N3O3S2 MolecularWeight: 389.49176

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NCCC(=O)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H19N3O3S2/c1-12-7-8-13(2)16(11-12)26(23,24)19-10-9-17(22)21-18-20-14-5-3-4-6-15(14)25-18/h3-8,11,19H,9-10H2,1-2H3,(H,20,21,22)