2-[4-[(3-methoxyphenyl)carbamothioylamino]phenyl]ethanoic acid

Systemtic Name: 2-[4-[(3-methoxyphenyl)carbamothioylamino]phenyl]ethanoic acid Openeye Name: 2-[4-[(3-methoxyphenyl)carbamothioylamino]phenyl]acetic acid CAS Name: 2-[4-[[(3-methoxyanilino)-sulfanylidenemethyl]amino]phenyl]acetic acid IUPAC Name: 2-[4-[(3-methoxyphenyl)carbamothioylamino]phenyl]acetic acid Traditional Name: 2-[4-[(3-methoxyphenyl)thiocarbamoylamino]phenyl]acetic acid Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NC2=CC=C(C=C2)CC(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC2=CC=C(C=C2)CC(=O)O

InChI

InChI=1S/C16H16N2O3S/c1-21-14-4-2-3-13(10-14)18-16(22)17-12-7-5-11(6-8-12)9-15(19)20/h2-8,10H,9H2,1H3,(H,19,20)(H2,17,18,22)