3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methyl-benzoic acid

Systemtic Name: 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methyl-benzoic acid Openeye Name: 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methyl-benzoic acid CAS Name: 3-[[(2,5-dimethoxyanilino)-sulfanylidenemethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-[(2,5-dimethoxyphenyl)carbamothioylamino]-4-methylbenzoic acid Traditional Name: 3-[(2,5-dimethoxyphenyl)thiocarbamoylamino]-4-methyl-benzoic acid Formula: C17H18N2O4S MolecularWeight: 346.40082

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N2O4S/c1-10-4-5-11(16(20)21)8-13(10)18-17(24)19-14-9-12(22-2)6-7-15(14)23-3/h4-9H,1-3H3,(H,20,21)(H2,18,19,24)