methyl (2S)-4-(phenylcarbamoyl)-1-thiophen-2-ylcarbonyl-piperazine-2-carboxylate

Systemtic Name: methyl (2S)-4-(phenylcarbamoyl)-1-thiophen-2-ylcarbonyl-piperazine-2-carboxylate Openeye Name: methyl (2S)-4-(phenylcarbamoyl)-1-(thiophene-2-carbonyl)piperazine-2-carboxylate CAS Name: (2S)-4-[anilino(oxo)methyl]-1-[oxo(thiophen-2-yl)methyl]-2-piperazinecarboxylic acid methyl ester IUPAC Name: methyl (2S)-4-(phenylcarbamoyl)-1-(thiophene-2-carbonyl)piperazine-2-carboxylate Traditional Name: (2S)-4-(phenylcarbamoyl)-1-(2-thenoyl)piperazine-2-carboxylic acid methyl ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CN(CCN1C(=O)C2=CC=CS2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

COC(=O)[C@@H]1CN(CCN1C(=O)C2=CC=CS2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H19N3O4S/c1-25-17(23)14-12-20(18(24)19-13-6-3-2-4-7-13)9-10-21(14)16(22)15-8-5-11-26-15/h2-8,11,14H,9-10,12H2,1H3,(H,19,24)/t14-/m0/s1