5-(1,3-benzothiazol-2-yl)-N-(3-methylsulfonylphenyl)pentanamide

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-N-(3-methylsulfonylphenyl)pentanamide Openeye Name: 5-(1,3-benzothiazol-2-yl)-N-(3-methylsulfonylphenyl)pentanamide CAS Name: 5-(1,3-benzothiazol-2-yl)-N-(3-methylsulfonylphenyl)pentanamide IUPAC Name: 5-(1,3-benzothiazol-2-yl)-N-(3-methylsulfonylphenyl)pentanamide Traditional Name: 5-(1,3-benzothiazol-2-yl)-N-(3-mesylphenyl)valeramide Formula: C19H20N2O3S2 MolecularWeight: 388.5037

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)CCCCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CS(=O)(=O)C1=CC=CC(=C1)NC(=O)CCCCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C19H20N2O3S2/c1-26(23,24)15-8-6-7-14(13-15)20-18(22)11-4-5-12-19-21-16-9-2-3-10-17(16)25-19/h2-3,6-10,13H,4-5,11-12H2,1H3,(H,20,22)