2-[[5-[(Z)-N-(tert-butylcarbamothioylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoate

Systemtic Name: 2-[[5-[(Z)-N-(tert-butylcarbamothioylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]ethanoate Openeye Name: 2-[[5-[(Z)-N-(tert-butylcarbamothioylamino)-C-methyl-carbonimidoyl]-2-methoxy-phenyl]methylsulfanyl]acetate CAS Name: 2-[[5-[(1Z)-1-[[(tert-butylamino)-sulfanylidenemethyl]hydrazinylidene]ethyl]-2-methoxyphenyl]methylthio]acetate IUPAC Name: 2-[[5-[(Z)-N-(tert-butylcarbamothioylamino)-C-methylcarbonimidoyl]-2-methoxyphenyl]methylsulfanyl]acetate Traditional Name: 2-[[5-[(Z)-N-(tert-butylthiocarbamoylamino)-C-methyl-carbonimidoyl]-2-methoxy-benzyl]thio]acetate Formula: C17H24N3O3S2- MolecularWeight: 382.52076

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC(C)(C)C)C1=CC(=C(C=C1)OC)CSCC(=O)[O-]

Isomeric SMILES

C/C(=N/NC(=S)NC(C)(C)C)/C1=CC(=C(C=C1)OC)CSCC(=O)[O-]

InChI

InChI=1S/C17H25N3O3S2/c1-11(19-20-16(24)18-17(2,3)4)12-6-7-14(23-5)13(8-12)9-25-10-15(21)22/h6-8H,9-10H2,1-5H3,(H,21,22)(H2,18,20,24)/p-1/b19-11-