2-[[2-(2-cyanophenoxy)ethanoylamino]carbamothioylamino]ethyl-dimethyl-azanium

Systemtic Name: 2-[[2-(2-cyanophenoxy)ethanoylamino]carbamothioylamino]ethyl-dimethyl-azanium Openeye Name: 2-[[[2-(2-cyanophenoxy)acetyl]amino]carbamothioylamino]ethyl-dimethyl-ammonium CAS Name: 2-[[[[2-(2-cyanophenoxy)-1-oxoethyl]hydrazo]-sulfanylidenemethyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[[[2-(2-cyanophenoxy)acetyl]amino]carbamothioylamino]ethyl-dimethylazanium Traditional Name: 2-[[[2-(2-cyanophenoxy)acetyl]amino]thiocarbamoylamino]ethyl-dimethyl-ammonium Formula: C14H20N5O2S+ MolecularWeight: 322.4059

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCNC(=S)NNC(=O)COC1=CC=CC=C1C#N

Isomeric SMILES

C[NH+](C)CCNC(=S)NNC(=O)COC1=CC=CC=C1C#N

InChI

InChI=1S/C14H19N5O2S/c1-19(2)8-7-16-14(22)18-17-13(20)10-21-12-6-4-3-5-11(12)9-15/h3-6H,7-8,10H2,1-2H3,(H,17,20)(H2,16,18,22)/p+1