2-[(3-ethylphenyl)methylsulfonyl-pentyl-amino]ethanethioamide

Systemtic Name: 2-[(3-ethylphenyl)methylsulfonyl-pentyl-amino]ethanethioamide Openeye Name: 2-[(3-ethylphenyl)methylsulfonyl-pentyl-amino]thioacetamide CAS Name: 2-[(3-ethylphenyl)methylsulfonyl-pentylamino]ethanethioamide IUPAC Name: 2-[(3-ethylphenyl)methylsulfonyl-pentylamino]ethanethioamide Traditional Name: 2-[amyl-(3-ethylbenzyl)sulfonyl-amino]thioacetamide Formula: C16H26N2O2S2 MolecularWeight: 342.51984

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC(=S)N)S(=O)(=O)CC1=CC=CC(=C1)CC

Isomeric SMILES

CCCCCN(CC(=S)N)S(=O)(=O)CC1=CC=CC(=C1)CC

InChI

InChI=1S/C16H26N2O2S2/c1-3-5-6-10-18(12-16(17)21)22(19,20)13-15-9-7-8-14(4-2)11-15/h7-9,11H,3-6,10,12-13H2,1-2H3,(H2,17,21)