3-(2-methoxyethylcarbamothioylamino)-4-methyl-benzoic acid

Systemtic Name: 3-(2-methoxyethylcarbamothioylamino)-4-methyl-benzoic acid Openeye Name: 3-(2-methoxyethylcarbamothioylamino)-4-methyl-benzoic acid CAS Name: 3-[[(2-methoxyethylamino)-sulfanylidenemethyl]amino]-4-methylbenzoic acid IUPAC Name: 3-(2-methoxyethylcarbamothioylamino)-4-methylbenzoic acid Traditional Name: 3-(2-methoxyethylthiocarbamoylamino)-4-methyl-benzoic acid Formula: C12H16N2O3S MolecularWeight: 268.33204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NCCOC

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)O)NC(=S)NCCOC

InChI

InChI=1S/C12H16N2O3S/c1-8-3-4-9(11(15)16)7-10(8)14-12(18)13-5-6-17-2/h3-4,7H,5-6H2,1-2H3,(H,15,16)(H2,13,14,18)