2-[8-[2-(propylcarbamothioylamino)ethyl]naphthalen-2-yl]oxyethanoic acid

Systemtic Name: 2-[8-[2-(propylcarbamothioylamino)ethyl]naphthalen-2-yl]oxyethanoic acid Openeye Name: 2-[[8-[2-(propylcarbamothioylamino)ethyl]-2-naphthyl]oxy]acetic acid CAS Name: 2-[[8-[2-[[propylamino(sulfanylidene)methyl]amino]ethyl]-2-naphthalenyl]oxy]acetic acid IUPAC Name: 2-[8-[2-(propylcarbamothioylamino)ethyl]naphthalen-2-yl]oxyacetic acid Traditional Name: 2-[8-[2-(propylthiocarbamoylamino)ethyl]-2-naphthoxy]acetic acid Formula: C18H22N2O3S MolecularWeight: 346.44388

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)NCCC1=CC=CC2=C1C=C(C=C2)OCC(=O)O

Isomeric SMILES

CCCNC(=S)NCCC1=CC=CC2=C1C=C(C=C2)OCC(=O)O

InChI

InChI=1S/C18H22N2O3S/c1-2-9-19-18(24)20-10-8-14-5-3-4-13-6-7-15(11-16(13)14)23-12-17(21)22/h3-7,11H,2,8-10,12H2,1H3,(H,21,22)(H2,19,20,24)