2-azanyl-N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-nitrophenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-propanamide

Systemtic Name: 2-azanyl-N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-nitrophenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-propanamide Openeye Name: 2-amino-N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-nitrophenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-propanamide CAS Name: 2-amino-N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-nitrophenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-2-methylpropanamide IUPAC Name: 2-amino-N-[(1R)-2-(1H-indol-3-yl)-1-[4-[(4-nitrophenyl)methyl]-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-2-methylpropanamide Traditional Name: 2-amino-N-[(1R)-2-(1H-indol-3-yl)-1-[4-(4-nitrobenzyl)-5-phenethyl-1,2,4-triazol-3-yl]ethyl]-2-methyl-propionamide Formula: C31H33N7O3 MolecularWeight: 551.63882

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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)[N+](=O)[O-])CCC5=CC=CC=C5)N

Isomeric SMILES

CC(C)(C(=O)N[C@H](CC1=CNC2=CC=CC=C21)C3=NN=C(N3CC4=CC=C(C=C4)[N+](=O)[O-])CCC5=CC=CC=C5)N

InChI

InChI=1S/C31H33N7O3/c1-31(2,32)30(39)34-27(18-23-19-33-26-11-7-6-10-25(23)26)29-36-35-28(17-14-21-8-4-3-5-9-21)37(29)20-22-12-15-24(16-13-22)38(40)41/h3-13,15-16,19,27,33H,14,17-18,20,32H2,1-2H3,(H,34,39)/t27-/m1/s1