1-[(4-methylphenyl)methylsulfonyl]-N-methylsulfonyl-azepane-2-carboxamide

Systemtic Name: 1-[(4-methylphenyl)methylsulfonyl]-N-methylsulfonyl-azepane-2-carboxamide Openeye Name: N-methylsulfonyl-1-(p-tolylmethylsulfonyl)azepane-2-carboxamide CAS Name: 1-[(4-methylphenyl)methylsulfonyl]-N-methylsulfonyl-2-azepanecarboxamide IUPAC Name: 1-[(4-methylphenyl)methylsulfonyl]-N-methylsulfonylazepane-2-carboxamide Traditional Name: N-mesyl-1-(4-methylbenzyl)sulfonyl-azepane-2-carboxamide Formula: C16H24N2O5S2 MolecularWeight: 388.50216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CS(=O)(=O)N2CCCCCC2C(=O)NS(=O)(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)CS(=O)(=O)N2CCCCCC2C(=O)NS(=O)(=O)C

InChI

InChI=1S/C16H24N2O5S2/c1-13-7-9-14(10-8-13)12-25(22,23)18-11-5-3-4-6-15(18)16(19)17-24(2,20)21/h7-10,15H,3-6,11-12H2,1-2H3,(H,17,19)