(2-methylphenyl)-(3-methylsulfanylpropylcarbamoyl)carbamic acid

Systemtic Name: (2-methylphenyl)-(3-methylsulfanylpropylcarbamoyl)carbamic acid Openeye Name: 3-methylsulfanylpropylcarbamoyl(o-tolyl)carbamic acid CAS Name: (2-methylphenyl)-[[3-(methylthio)propylamino]-oxomethyl]carbamic acid IUPAC Name: (2-methylphenyl)-(3-methylsulfanylpropylcarbamoyl)carbamic acid Traditional Name: 3-(methylthio)propylcarbamoyl-(o-tolyl)carbamic acid Formula: C13H18N2O3S MolecularWeight: 282.35862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C(=O)NCCCSC)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1N(C(=O)NCCCSC)C(=O)O

InChI

InChI=1S/C13H18N2O3S/c1-10-6-3-4-7-11(10)15(13(17)18)12(16)14-8-5-9-19-2/h3-4,6-7H,5,8-9H2,1-2H3,(H,14,16)(H,17,18)