5-(1,2-dithiolan-3-yl)-N-[1-(4-methylsulfonylphenyl)ethyl]pentanamide

Systemtic Name: 5-(1,2-dithiolan-3-yl)-N-[1-(4-methylsulfonylphenyl)ethyl]pentanamide Openeye Name: 5-(dithiolan-3-yl)-N-[1-(4-methylsulfonylphenyl)ethyl]pentanamide CAS Name: 5-(3-dithiolanyl)-N-[1-(4-methylsulfonylphenyl)ethyl]pentanamide IUPAC Name: 5-(dithiolan-3-yl)-N-[1-(4-methylsulfonylphenyl)ethyl]pentanamide Traditional Name: 5-(dithiolan-3-yl)-N-[1-(4-mesylphenyl)ethyl]valeramide Formula: C17H25NO3S3 MolecularWeight: 387.5803

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CCCCC2CCSS2

Isomeric SMILES

CC(C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)CCCCC2CCSS2

InChI

InChI=1S/C17H25NO3S3/c1-13(14-7-9-16(10-8-14)24(2,20)21)18-17(19)6-4-3-5-15-11-12-22-23-15/h7-10,13,15H,3-6,11-12H2,1-2H3,(H,18,19)