4-(1H-indol-2-ylcarbonyl)-N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxamide

Systemtic Name: 4-(1H-indol-2-ylcarbonyl)-N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxidanylidene-propan-2-yl]piperazine-1-carboxamide Openeye Name: 4-(1H-indole-2-carbonyl)-N-[(1S)-2-[2-(1H-indol-3-yl)ethylamino]-1-methyl-2-oxo-ethyl]piperazine-1-carboxamide CAS Name: N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxopropan-2-yl]-4-[1H-indol-2-yl(oxo)methyl]-1-piperazinecarboxamide IUPAC Name: 4-(1H-indole-2-carbonyl)-N-[(2S)-1-[2-(1H-indol-3-yl)ethylamino]-1-oxopropan-2-yl]piperazine-1-carboxamide Traditional Name: 4-(1H-indole-2-carbonyl)-N-[(1S)-2-[2-(1H-indol-3-yl)ethylamino]-2-keto-1-methyl-ethyl]piperazine-1-carboxamide Formula: C27H30N6O3 MolecularWeight: 486.5655

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CNC2=CC=CC=C21)NC(=O)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5N4

Isomeric SMILES

C[C@@H](C(=O)NCCC1=CNC2=CC=CC=C21)NC(=O)N3CCN(CC3)C(=O)C4=CC5=CC=CC=C5N4

InChI

InChI=1S/C27H30N6O3/c1-18(25(34)28-11-10-20-17-29-23-9-5-3-7-21(20)23)30-27(36)33-14-12-32(13-15-33)26(35)24-16-19-6-2-4-8-22(19)31-24/h2-9,16-18,29,31H,10-15H2,1H3,(H,28,34)(H,30,36)/t18-/m0/s1