methyl 2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-(1,3-benzothiazol-2-ylsulfanyl)ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-benzothiazol-2-ylthio)-1-oxoethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1,3-benzothiazol-2-ylsulfanyl)acetyl]amino]thiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylthio)acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C15H12N2O3S3 MolecularWeight: 364.46238

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC=C1)NC(=O)CSC2=NC3=CC=CC=C3S2

Isomeric SMILES

COC(=O)C1=C(SC=C1)NC(=O)CSC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H12N2O3S3/c1-20-14(19)9-6-7-21-13(9)17-12(18)8-22-15-16-10-4-2-3-5-11(10)23-15/h2-7H,8H2,1H3,(H,17,18)