ethyl 4-aminocarbonyl-5-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-2-methyl-furan-3-carboxylate

Systemtic Name: ethyl 4-aminocarbonyl-5-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-2-methyl-furan-3-carboxylate Openeye Name: ethyl 5-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-4-carbamoyl-2-methyl-furan-3-carboxylate CAS Name: 5-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-4-carbamoyl-2-methyl-3-furancarboxylic acid ethyl ester IUPAC Name: ethyl 5-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-4-carbamoyl-2-methylfuran-3-carboxylate Traditional Name: 5-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]-4-carbamoyl-2-methyl-furan-3-carboxylic acid ethyl ester Formula: C18H17N3O5S2 MolecularWeight: 419.47468

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC2=NC3=CC=CC=C3S2)C

Isomeric SMILES

CCOC(=O)C1=C(OC(=C1C(=O)N)NC(=O)CSC2=NC3=CC=CC=C3S2)C

InChI

InChI=1S/C18H17N3O5S2/c1-3-25-17(24)13-9(2)26-16(14(13)15(19)23)21-12(22)8-27-18-20-10-6-4-5-7-11(10)28-18/h4-7H,3,8H2,1-2H3,(H2,19,23)(H,21,22)