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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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