2-[4-[(2-methylphenyl)carbamoylamino]-3-methylsulfanyl-phenyl]ethanoic acid

Systemtic Name: 2-[4-[(2-methylphenyl)carbamoylamino]-3-methylsulfanyl-phenyl]ethanoic acid Openeye Name: 2-[3-methylsulfanyl-4-(o-tolylcarbamoylamino)phenyl]acetic acid CAS Name: 2-[4-[[(2-methylanilino)-oxomethyl]amino]-3-(methylthio)phenyl]acetic acid IUPAC Name: 2-[4-[(2-methylphenyl)carbamoylamino]-3-methylsulfanylphenyl]acetic acid Traditional Name: 2-[3-(methylthio)-4-(o-tolylcarbamoylamino)phenyl]acetic acid Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)O)SC

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=C(C=C(C=C2)CC(=O)O)SC

InChI

InChI=1S/C17H18N2O3S/c1-11-5-3-4-6-13(11)18-17(22)19-14-8-7-12(10-16(20)21)9-15(14)23-2/h3-9H,10H2,1-2H3,(H,20,21)(H2,18,19,22)