2-[4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[(2-methoxy-5-methyl-phenyl)carbamothioylamino]phenyl]acetic acid CAS Name: 2-[4-[[(2-methoxy-5-methylanilino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(2-methoxy-5-methylphenyl)carbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[(2-methoxy-5-methyl-phenyl)thiocarbamoylamino]phenyl]acetic acid Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=S)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=S)NC2=CC=C(C=C2)CC(=O)O

InChI

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