2-[[3-(aminomethyl)phenyl]methyl-[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-N-tert-butyl-propanamide

Systemtic Name: 2-[[3-(aminomethyl)phenyl]methyl-[2-(1H-indol-3-yl)-2-oxidanylidene-ethanoyl]amino]-N-tert-butyl-propanamide Openeye Name: 2-[[3-(aminomethyl)phenyl]methyl-[2-(1H-indol-3-yl)-2-oxo-acetyl]amino]-N-tert-butyl-propanamide CAS Name: 2-[[3-(aminomethyl)phenyl]methyl-[2-(1H-indol-3-yl)-1,2-dioxoethyl]amino]-N-tert-butylpropanamide IUPAC Name: 2-[[3-(aminomethyl)phenyl]methyl-[2-(1H-indol-3-yl)-2-oxoacetyl]amino]-N-tert-butylpropanamide Traditional Name: 2-[[3-(aminomethyl)benzyl]-[2-(1H-indol-3-yl)-2-keto-acetyl]amino]-N-tert-butyl-propionamide Formula: C25H30N4O3 MolecularWeight: 434.5307

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)N(CC1=CC=CC(=C1)CN)C(=O)C(=O)C2=CNC3=CC=CC=C32

Isomeric SMILES

CC(C(=O)NC(C)(C)C)N(CC1=CC=CC(=C1)CN)C(=O)C(=O)C2=CNC3=CC=CC=C32

InChI

InChI=1S/C25H30N4O3/c1-16(23(31)28-25(2,3)4)29(15-18-9-7-8-17(12-18)13-26)24(32)22(30)20-14-27-21-11-6-5-10-19(20)21/h5-12,14,16,27H,13,15,26H2,1-4H3,(H,28,31)