4-(1,3-benzothiazol-2-yl)-N-(4-methylsulfonylphenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methylsulfonylphenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methylsulfonylphenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methylsulfonylphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methylsulfonylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(4-mesylphenyl)butyramide Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C18H18N2O3S2/c1-25(22,23)14-11-9-13(10-12-14)19-17(21)7-4-8-18-20-15-5-2-3-6-16(15)24-18/h2-3,5-6,9-12H,4,7-8H2,1H3,(H,19,21)