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

Systemtic Name: methyl 3-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C15H12N2O4S2 MolecularWeight: 348.39678

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C15H12N2O4S2/c1-20-14(19)13-10(6-7-22-13)16-12(18)8-23-15-17-9-4-2-3-5-11(9)21-15/h2-7H,8H2,1H3,(H,16,18)