2-[(3-butylphenyl)methylsulfonyl-methyl-amino]ethanethioamide

Systemtic Name: 2-[(3-butylphenyl)methylsulfonyl-methyl-amino]ethanethioamide Openeye Name: 2-[(3-butylphenyl)methylsulfonyl-methyl-amino]thioacetamide CAS Name: 2-[(3-butylphenyl)methylsulfonyl-methylamino]ethanethioamide IUPAC Name: 2-[(3-butylphenyl)methylsulfonyl-methylamino]ethanethioamide Traditional Name: 2-[(3-butylbenzyl)sulfonyl-methyl-amino]thioacetamide Formula: C14H22N2O2S2 MolecularWeight: 314.46668

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=CC=C1)CS(=O)(=O)N(C)CC(=S)N

Isomeric SMILES

CCCCC1=CC(=CC=C1)CS(=O)(=O)N(C)CC(=S)N

InChI

InChI=1S/C14H22N2O2S2/c1-3-4-6-12-7-5-8-13(9-12)11-20(17,18)16(2)10-14(15)19/h5,7-9H,3-4,6,10-11H2,1-2H3,(H2,15,19)