2-[4-(cyclohexylcarbamothioylamino)phenyl]ethanoic acid

Systemtic Name: 2-[4-(cyclohexylcarbamothioylamino)phenyl]ethanoic acid Openeye Name: 2-[4-(cyclohexylcarbamothioylamino)phenyl]acetic acid CAS Name: 2-[4-[[(cyclohexylamino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-(cyclohexylcarbamothioylamino)phenyl]acetic acid Traditional Name: 2-[4-(cyclohexylthiocarbamoylamino)phenyl]acetic acid Formula: C15H20N2O2S MolecularWeight: 292.3965

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

C1CCC(CC1)NC(=S)NC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C15H20N2O2S/c18-14(19)10-11-6-8-13(9-7-11)17-15(20)16-12-4-2-1-3-5-12/h6-9,12H,1-5,10H2,(H,18,19)(H2,16,17,20)