methyl 4-[(3-methyl-1-benzofuran-2-yl)carbonylcarbamothioylamino]benzoate

Systemtic Name: methyl 4-[(3-methyl-1-benzofuran-2-yl)carbonylcarbamothioylamino]benzoate Openeye Name: methyl 4-[(3-methylbenzofuran-2-carbonyl)carbamothioylamino]benzoate CAS Name: 4-[[[[(3-methyl-2-benzofuranyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(3-methyl-1-benzofuran-2-carbonyl)carbamothioylamino]benzoate Traditional Name: 4-[(3-methylbenzofuran-2-carbonyl)thiocarbamoylamino]benzoic acid methyl ester Formula: C19H16N2O4S MolecularWeight: 368.40634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(OC2=CC=CC=C12)C(=O)NC(=S)NC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C19H16N2O4S/c1-11-14-5-3-4-6-15(14)25-16(11)17(22)21-19(26)20-13-9-7-12(8-10-13)18(23)24-2/h3-10H,1-2H3,(H2,20,21,22,26)