3-(1H-indol-3-yl)-2-[2-[3-methyl-2,5-bis(oxidanylidene)piperazin-1-yl]ethanoylamino]-N-[[3,4,5-tris(chloranyl)phenyl]methyl]propanamide

Systemtic Name: 3-(1H-indol-3-yl)-2-[2-[3-methyl-2,5-bis(oxidanylidene)piperazin-1-yl]ethanoylamino]-N-[[3,4,5-tris(chloranyl)phenyl]methyl]propanamide Openeye Name: 3-(1H-indol-3-yl)-2-[[2-(3-methyl-2,5-dioxo-piperazin-1-yl)acetyl]amino]-N-[(3,4,5-trichlorophenyl)methyl]propanamide CAS Name: 3-(1H-indol-3-yl)-2-[[2-(3-methyl-2,5-dioxo-1-piperazinyl)-1-oxoethyl]amino]-N-[(3,4,5-trichlorophenyl)methyl]propanamide IUPAC Name: 3-(1H-indol-3-yl)-2-[[2-(3-methyl-2,5-dioxopiperazin-1-yl)acetyl]amino]-N-[(3,4,5-trichlorophenyl)methyl]propanamide Traditional Name: 2-[[2-(2,5-diketo-3-methyl-piperazino)acetyl]amino]-3-(1H-indol-3-yl)-N-(3,4,5-trichlorobenzyl)propionamide Formula: C25H24Cl3N5O4 MolecularWeight: 564.84816

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC(=O)N1)CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC4=CC(=C(C(=C4)Cl)Cl)Cl

Isomeric SMILES

CC1C(=O)N(CC(=O)N1)CC(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)NCC4=CC(=C(C(=C4)Cl)Cl)Cl

InChI

InChI=1S/C25H24Cl3N5O4/c1-13-25(37)33(11-21(34)31-13)12-22(35)32-20(8-15-10-29-19-5-3-2-4-16(15)19)24(36)30-9-14-6-17(26)23(28)18(27)7-14/h2-7,10,13,20,29H,8-9,11-12H2,1H3,(H,30,36)(H,31,34)(H,32,35)