methyl (2R)-2-[[(2S)-4-(propan-2-ylcarbamoyl)-1-thiophen-2-ylcarbonyl-piperazin-2-yl]carbonylamino]propanoate

Systemtic Name: methyl (2R)-2-[[(2S)-4-(propan-2-ylcarbamoyl)-1-thiophen-2-ylcarbonyl-piperazin-2-yl]carbonylamino]propanoate Openeye Name: methyl (2R)-2-[[(2S)-4-(isopropylcarbamoyl)-1-(thiophene-2-carbonyl)piperazine-2-carbonyl]amino]propanoate CAS Name: (2R)-2-[[oxo-[(2S)-4-[oxo-(propan-2-ylamino)methyl]-1-[oxo(thiophen-2-yl)methyl]-2-piperazinyl]methyl]amino]propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2S)-4-(propan-2-ylcarbamoyl)-1-(thiophene-2-carbonyl)piperazine-2-carbonyl]amino]propanoate Traditional Name: (2R)-2-[[(2S)-4-(isopropylcarbamoyl)-1-(2-thenoyl)piperazine-2-carbonyl]amino]propionic acid methyl ester Formula: C18H26N4O5S MolecularWeight: 410.48784

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(C(C1)C(=O)NC(C)C(=O)OC)C(=O)C2=CC=CS2

Isomeric SMILES

C[C@H](C(=O)OC)NC(=O)[C@@H]1CN(CCN1C(=O)C2=CC=CS2)C(=O)NC(C)C

InChI

InChI=1S/C18H26N4O5S/c1-11(2)19-18(26)21-7-8-22(16(24)14-6-5-9-28-14)13(10-21)15(23)20-12(3)17(25)27-4/h5-6,9,11-13H,7-8,10H2,1-4H3,(H,19,26)(H,20,23)/t12-,13+/m1/s1