2-[4-(cyclohexylcarbamothioyl)-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(cyclohexylcarbamothioyl)-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-(cyclohexylcarbamothioyl)-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-[(cyclohexylamino)-sulfanylidenemethyl]-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-(cyclohexylcarbamothioyl)-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-(cyclohexylthiocarbamoyl)-2-methoxy-phenoxy]acetic acid Formula: C16H21NO4S MolecularWeight: 323.40724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=S)NC2CCCCC2)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)C(=S)NC2CCCCC2)OCC(=O)O

InChI

InChI=1S/C16H21NO4S/c1-20-14-9-11(7-8-13(14)21-10-15(18)19)16(22)17-12-5-3-2-4-6-12/h7-9,12H,2-6,10H2,1H3,(H,17,22)(H,18,19)