2-[3-[(Z)-N-(cyclohexylcarbamothioylamino)-C-methyl-carbonimidoyl]phenoxy]ethanoic acid

Systemtic Name: 2-[3-[(Z)-N-(cyclohexylcarbamothioylamino)-C-methyl-carbonimidoyl]phenoxy]ethanoic acid Openeye Name: 2-[3-[(Z)-N-(cyclohexylcarbamothioylamino)-C-methyl-carbonimidoyl]phenoxy]acetic acid CAS Name: 2-[3-[(1Z)-1-[[(cyclohexylamino)-sulfanylidenemethyl]hydrazinylidene]ethyl]phenoxy]acetic acid IUPAC Name: 2-[3-[(Z)-N-(cyclohexylcarbamothioylamino)-C-methylcarbonimidoyl]phenoxy]acetic acid Traditional Name: 2-[3-[(Z)-N-(cyclohexylthiocarbamoylamino)-C-methyl-carbonimidoyl]phenoxy]acetic acid Formula: C17H23N3O3S MolecularWeight: 349.44782

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1CCCCC1)C2=CC(=CC=C2)OCC(=O)O

Isomeric SMILES

C/C(=N/NC(=S)NC1CCCCC1)/C2=CC(=CC=C2)OCC(=O)O

InChI

InChI=1S/C17H23N3O3S/c1-12(13-6-5-9-15(10-13)23-11-16(21)22)19-20-17(24)18-14-7-3-2-4-8-14/h5-6,9-10,14H,2-4,7-8,11H2,1H3,(H,21,22)(H2,18,20,24)/b19-12-