2-azanyl-N-[(1R)-1-[4-[(4-bromophenyl)methyl]-5-[3-(1H-indol-3-yl)propyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methyl-propanamide; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: 2-azanyl-N-[(1R)-1-[4-[(4-bromophenyl)methyl]-5-[3-(1H-indol-3-yl)propyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methyl-propanamide; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: 2-amino-N-[(1R)-1-[4-[(4-bromophenyl)methyl]-5-[3-(1H-indol-3-yl)propyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methyl-propanamide; 2,2,2-trifluoroacetic acid CAS Name: 2-amino-N-[(1R)-1-[4-[(4-bromophenyl)methyl]-5-[3-(1H-indol-3-yl)propyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methylpropanamide; 2,2,2-trifluoroacetic acid IUPAC Name: 2-amino-N-[(1R)-1-[4-[(4-bromophenyl)methyl]-5-[3-(1H-indol-3-yl)propyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methylpropanamide; 2,2,2-trifluoroacetic acid Traditional Name: 2-amino-N-[(1R)-1-[4-(4-bromobenzyl)-5-[3-(1H-indol-3-yl)propyl]-1,2,4-triazol-3-yl]-2-(1H-indol-3-yl)ethyl]-2-methyl-propionamide; 2,2,2-trifluoroacetic acid Formula: C36H37BrF3N7O3 MolecularWeight: 752.62329

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC(CC1=CNC2=CC=CC=C21)C3=NN=C(N3CC4=CC=C(C=C4)Br)CCCC5=CNC6=CC=CC=C65)N.C(=O)(C(F)(F)F)O

Isomeric SMILES

CC(C)(C(=O)N[C@H](CC1=CNC2=CC=CC=C21)C3=NN=C(N3CC4=CC=C(C=C4)Br)CCCC5=CNC6=CC=CC=C65)N.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C34H36BrN7O.C2HF3O2/c1-34(2,36)33(43)39-30(18-24-20-38-29-12-6-4-10-27(24)29)32-41-40-31(42(32)21-22-14-16-25(35)17-15-22)13-7-8-23-19-37-28-11-5-3-9-26(23)28;3-2(4,5)1(6)7/h3-6,9-12,14-17,19-20,30,37-38H,7-8,13,18,21,36H2,1-2H3,(H,39,43);(H,6,7)/t30-;/m1./s1