2-[4-[(Z)-N-(butylcarbamothioylamino)-C-ethyl-carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[4-[(Z)-N-(butylcarbamothioylamino)-C-ethyl-carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[4-[(Z)-N-(butylcarbamothioylamino)-C-ethyl-carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[4-[(1Z)-1-[[butylamino(sulfanylidene)methyl]hydrazinylidene]propyl]phenoxy]acetic acid IUPAC Name: 2-[4-[(Z)-N-(butylcarbamothioylamino)-C-ethylcarbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[4-[(Z)-N-(butylthiocarbamoylamino)-C-ethyl-carbonimidoyl]phenoxy]acetic acid Formula: C16H23N3O3S MolecularWeight: 337.43712

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NN=C(CC)C1=CC=C(C=C1)OCC(=O)O

Isomeric SMILES

CCCCNC(=S)N/N=C(/CC)\C1=CC=C(C=C1)OCC(=O)O

InChI

InChI=1S/C16H23N3O3S/c1-3-5-10-17-16(23)19-18-14(4-2)12-6-8-13(9-7-12)22-11-15(20)21/h6-9H,3-5,10-11H2,1-2H3,(H,20,21)(H2,17,19,23)/b18-14-