3-methylsulfanylpropylcarbamoyl-[3-(trifluoromethyl)phenyl]carbamic acid

Systemtic Name: 3-methylsulfanylpropylcarbamoyl-[3-(trifluoromethyl)phenyl]carbamic acid Openeye Name: 3-methylsulfanylpropylcarbamoyl-[3-(trifluoromethyl)phenyl]carbamic acid CAS Name: [[3-(methylthio)propylamino]-oxomethyl]-[3-(trifluoromethyl)phenyl]carbamic acid IUPAC Name: 3-methylsulfanylpropylcarbamoyl-[3-(trifluoromethyl)phenyl]carbamic acid Traditional Name: 3-(methylthio)propylcarbamoyl-[3-(trifluoromethyl)phenyl]carbamic acid Formula: C13H15F3N2O3S MolecularWeight: 336.33001

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Descriptors Computed from Structure

Canonical SMILES:

CSCCCNC(=O)N(C1=CC=CC(=C1)C(F)(F)F)C(=O)O

Isomeric SMILES

CSCCCNC(=O)N(C1=CC=CC(=C1)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H15F3N2O3S/c1-22-7-3-6-17-11(19)18(12(20)21)10-5-2-4-9(8-10)13(14,15)16/h2,4-5,8H,3,6-7H2,1H3,(H,17,19)(H,20,21)