methyl 5-aminocarbonyl-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-aminocarbonyl-2-[2-(1,3-benzoxazol-2-ylsulfanyl)ethanoylamino]-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylate CAS Name: 2-[[2-(1,3-benzoxazol-2-ylthio)-1-oxoethyl]amino]-5-carbamoyl-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-(1,3-benzoxazol-2-ylsulfanyl)acetyl]amino]-5-carbamoyl-4-methylthiophene-3-carboxylate Traditional Name: 2-[[2-(1,3-benzoxazol-2-ylthio)acetyl]amino]-5-carbamoyl-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C17H15N3O5S2 MolecularWeight: 405.4481

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC3=CC=CC=C3O2)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CSC2=NC3=CC=CC=C3O2)C(=O)N

InChI

InChI=1S/C17H15N3O5S2/c1-8-12(16(23)24-2)15(27-13(8)14(18)22)20-11(21)7-26-17-19-9-5-3-4-6-10(9)25-17/h3-6H,7H2,1-2H3,(H2,18,22)(H,20,21)