3-[5-[(3S)-1,2-dithiolan-3-yl]pentanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[5-[(3S)-1,2-dithiolan-3-yl]pentanoylamino]-N-methyl-benzamide Openeye Name: 3-[5-[(3S)-dithiolan-3-yl]pentanoylamino]-N-methyl-benzamide CAS Name: 3-[[5-[(3S)-3-dithiolanyl]-1-oxopentyl]amino]-N-methylbenzamide IUPAC Name: 3-[5-[(3S)-dithiolan-3-yl]pentanoylamino]-N-methylbenzamide Traditional Name: 3-[5-[(3S)-dithiolan-3-yl]pentanoylamino]-N-methyl-benzamide Formula: C16H22N2O2S2 MolecularWeight: 338.48808

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)CCCCC2CCSS2

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)CCCC[C@H]2CCSS2

InChI

InChI=1S/C16H22N2O2S2/c1-17-16(20)12-5-4-6-13(11-12)18-15(19)8-3-2-7-14-9-10-21-22-14/h4-6,11,14H,2-3,7-10H2,1H3,(H,17,20)(H,18,19)/t14-/m0/s1