methyl 3-(carbamothioylamino)-5-chloranyl-1-benzofuran-2-carboxylate

Systemtic Name: methyl 3-(carbamothioylamino)-5-chloranyl-1-benzofuran-2-carboxylate Openeye Name: methyl 3-(carbamothioylamino)-5-chloro-benzofuran-2-carboxylate CAS Name: 3-(carbamothioylamino)-5-chloro-2-benzofurancarboxylic acid methyl ester IUPAC Name: methyl 3-(carbamothioylamino)-5-chloro-1-benzofuran-2-carboxylate Traditional Name: 5-chloro-3-thioureido-coumarilic acid methyl ester Formula: C11H9ClN2O3S MolecularWeight: 284.71876

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C2=C(O1)C=CC(=C2)Cl)NC(=S)N

Isomeric SMILES

COC(=O)C1=C(C2=C(O1)C=CC(=C2)Cl)NC(=S)N

InChI

InChI=1S/C11H9ClN2O3S/c1-16-10(15)9-8(14-11(13)18)6-4-5(12)2-3-7(6)17-9/h2-4H,1H3,(H3,13,14,18)