methyl (2R)-2-[[(2S)-4-ethanoyl-1-thiophen-2-ylcarbonyl-piperazin-2-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2R)-2-[[(2S)-4-ethanoyl-1-thiophen-2-ylcarbonyl-piperazin-2-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2R)-2-[[(2S)-4-acetyl-1-(thiophene-2-carbonyl)piperazine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2R)-2-[[[(2S)-4-acetyl-1-[oxo(thiophen-2-yl)methyl]-2-piperazinyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2R)-2-[[(2S)-4-acetyl-1-(thiophene-2-carbonyl)piperazine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2R)-2-[[(2S)-4-acetyl-1-(2-thenoyl)piperazine-2-carbonyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C24H26N4O5S MolecularWeight: 482.55204

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(C(C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC)C(=O)C4=CC=CS4

Isomeric SMILES

CC(=O)N1CCN([C@@H](C1)C(=O)N[C@H](CC2=CNC3=CC=CC=C32)C(=O)OC)C(=O)C4=CC=CS4

InChI

InChI=1S/C24H26N4O5S/c1-15(29)27-9-10-28(23(31)21-8-5-11-34-21)20(14-27)22(30)26-19(24(32)33-2)12-16-13-25-18-7-4-3-6-17(16)18/h3-8,11,13,19-20,25H,9-10,12,14H2,1-2H3,(H,26,30)/t19-,20+/m1/s1