4-methoxy-3-[(2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]benzoic acid

Systemtic Name: 4-methoxy-3-[(2-methoxy-3-methyl-phenyl)carbonylcarbamothioylamino]benzoic acid Openeye Name: 4-methoxy-3-[(2-methoxy-3-methyl-benzoyl)carbamothioylamino]benzoic acid CAS Name: 4-methoxy-3-[[[[(2-methoxy-3-methylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid IUPAC Name: 4-methoxy-3-[(2-methoxy-3-methylbenzoyl)carbamothioylamino]benzoic acid Traditional Name: 4-methoxy-3-[(2-methoxy-3-methyl-benzoyl)thiocarbamoylamino]benzoic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)OC

Isomeric SMILES

CC1=CC=CC(=C1OC)C(=O)NC(=S)NC2=C(C=CC(=C2)C(=O)O)OC

InChI

InChI=1S/C18H18N2O5S/c1-10-5-4-6-12(15(10)25-3)16(21)20-18(26)19-13-9-11(17(22)23)7-8-14(13)24-2/h4-9H,1-3H3,(H,22,23)(H2,19,20,21,26)