methyl 3-[2-[(2R)-3-oxidanylidene-1-(phenylcarbonyl)piperazin-2-yl]ethanoylamino]thiophene-2-carboxylate

Systemtic Name: methyl 3-[2-[(2R)-3-oxidanylidene-1-(phenylcarbonyl)piperazin-2-yl]ethanoylamino]thiophene-2-carboxylate Openeye Name: methyl 3-[[2-[(2R)-1-benzoyl-3-oxo-piperazin-2-yl]acetyl]amino]thiophene-2-carboxylate CAS Name: 3-[[2-[(2R)-1-benzoyl-3-oxo-2-piperazinyl]-1-oxoethyl]amino]-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 3-[[2-[(2R)-1-benzoyl-3-oxopiperazin-2-yl]acetyl]amino]thiophene-2-carboxylate Traditional Name: 3-[[2-[(2R)-1-benzoyl-3-keto-piperazin-2-yl]acetyl]amino]thiophene-2-carboxylic acid methyl ester Formula: C19H19N3O5S MolecularWeight: 401.43626

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CS1)NC(=O)CC2C(=O)NCCN2C(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(C=CS1)NC(=O)C[C@@H]2C(=O)NCCN2C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H19N3O5S/c1-27-19(26)16-13(7-10-28-16)21-15(23)11-14-17(24)20-8-9-22(14)18(25)12-5-3-2-4-6-12/h2-7,10,14H,8-9,11H2,1H3,(H,20,24)(H,21,23)/t14-/m1/s1