N-(5-methylhexan-2-yl)-3-(phenylsulfonylmethyl)benzamide

Systemtic Name: N-(5-methylhexan-2-yl)-3-(phenylsulfonylmethyl)benzamide Openeye Name: 3-(benzenesulfonylmethyl)-N-(1,4-dimethylpentyl)benzamide CAS Name: 3-(benzenesulfonylmethyl)-N-(5-methylhexan-2-yl)benzamide IUPAC Name: 3-(benzenesulfonylmethyl)-N-(5-methylhexan-2-yl)benzamide Traditional Name: 3-(besylmethyl)-N-(1,4-dimethylpentyl)benzamide Formula: C21H27NO3S MolecularWeight: 373.50898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C)NC(=O)C1=CC(=CC=C1)CS(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CCC(C)NC(=O)C1=CC(=CC=C1)CS(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27NO3S/c1-16(2)12-13-17(3)22-21(23)19-9-7-8-18(14-19)15-26(24,25)20-10-5-4-6-11-20/h4-11,14,16-17H,12-13,15H2,1-3H3,(H,22,23)