ethyl 2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-4-(furan-2-yl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]-4-(furan-2-yl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-4-(2-furyl)thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-4-(2-furanyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]-4-(furan-2-yl)thiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]-4-(2-furyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H16N2O4S3 MolecularWeight: 444.54704

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CO2)NC(=O)CSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H16N2O4S3/c1-2-25-19(24)17-12(14-7-5-9-26-14)10-27-18(17)22-16(23)11-28-20-21-13-6-3-4-8-15(13)29-20/h3-10H,2,11H2,1H3,(H,22,23)