methyl 2-(furan-2-ylcarbonylcarbamothioylamino)-1,3-benzothiazole-6-carboxylate

Systemtic Name: methyl 2-(furan-2-ylcarbonylcarbamothioylamino)-1,3-benzothiazole-6-carboxylate Openeye Name: methyl 2-(furan-2-carbonylcarbamothioylamino)-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[[2-furanyl(oxo)methyl]amino]-sulfanylidenemethyl]amino]-1,3-benzothiazole-6-carboxylic acid methyl ester IUPAC Name: methyl 2-(furan-2-carbonylcarbamothioylamino)-1,3-benzothiazole-6-carboxylate Traditional Name: 2-(2-furoylthiocarbamoylamino)-1,3-benzothiazole-6-carboxylic acid methyl ester Formula: C15H11N3O4S2 MolecularWeight: 361.39554

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC=CO3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(S2)NC(=S)NC(=O)C3=CC=CO3

InChI

InChI=1S/C15H11N3O4S2/c1-21-13(20)8-4-5-9-11(7-8)24-15(16-9)18-14(23)17-12(19)10-3-2-6-22-10/h2-7H,1H3,(H2,16,17,18,19,23)