methyl 3-(furan-2-ylmethylcarbamothioylamino)-4-methyl-benzoate

Systemtic Name: methyl 3-(furan-2-ylmethylcarbamothioylamino)-4-methyl-benzoate Openeye Name: methyl 3-(2-furylmethylcarbamothioylamino)-4-methyl-benzoate CAS Name: 3-[[(2-furanylmethylamino)-sulfanylidenemethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-(furan-2-ylmethylcarbamothioylamino)-4-methylbenzoate Traditional Name: 3-(2-furfurylthiocarbamoylamino)-4-methyl-benzoic acid methyl ester Formula: C15H16N2O3S MolecularWeight: 304.36414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=S)NCC2=CC=CO2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=S)NCC2=CC=CO2

InChI

InChI=1S/C15H16N2O3S/c1-10-5-6-11(14(18)19-2)8-13(10)17-15(21)16-9-12-4-3-7-20-12/h3-8H,9H2,1-2H3,(H2,16,17,21)