2-[[2-(4-tert-butylphenoxy)ethanoylamino]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(4-tert-butylphenoxy)ethanoylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[[2-(4-tert-butylphenoxy)acetyl]amino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[2-(4-tert-butylphenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[[2-(4-tert-butylphenoxy)acetyl]amino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[[2-(4-tert-butylphenoxy)acetyl]amino]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C17H29N4O2S+ MolecularWeight: 353.50276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NCC[NH+](C)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCC(=O)NNC(=S)NCC[NH+](C)C

InChI

InChI=1S/C17H28N4O2S/c1-17(2,3)13-6-8-14(9-7-13)23-12-15(22)19-20-16(24)18-10-11-21(4)5/h6-9H,10-12H2,1-5H3,(H,19,22)(H2,18,20,24)/p+1