N-[4-tert-butylsulfanyl-3-(1-methylpyrrol-2-yl)phenoxy]ethanethioamide

Systemtic Name: N-[4-tert-butylsulfanyl-3-(1-methylpyrrol-2-yl)phenoxy]ethanethioamide Openeye Name: N-[4-tert-butylsulfanyl-3-(1-methylpyrrol-2-yl)phenoxy]thioacetamide CAS Name: N-[4-(tert-butylthio)-3-(1-methyl-2-pyrrolyl)phenoxy]ethanethioamide IUPAC Name: N-[4-tert-butylsulfanyl-3-(1-methylpyrrol-2-yl)phenoxy]ethanethioamide Traditional Name: N-[4-(tert-butylthio)-3-(1-methylpyrrol-2-yl)phenoxy]thioacetamide Formula: C17H22N2OS2 MolecularWeight: 334.49938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=S)NOC1=CC(=C(C=C1)SC(C)(C)C)C2=CC=CN2C

Isomeric SMILES

CC(=S)NOC1=CC(=C(C=C1)SC(C)(C)C)C2=CC=CN2C

InChI

InChI=1S/C17H22N2OS2/c1-12(21)18-20-13-8-9-16(22-17(2,3)4)14(11-13)15-7-6-10-19(15)5/h6-11H,1-5H3,(H,18,21)