tert-butyl N-[1-[5-(4-carbamimidoylphenyl)pyridin-3-yl]oxy-3-(1H-indol-3-yl)propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[5-(4-carbamimidoylphenyl)pyridin-3-yl]oxy-3-(1H-indol-3-yl)propan-2-yl]carbamate Openeye Name: tert-butyl N-[1-[[5-(4-carbamimidoylphenyl)-3-pyridyl]oxymethyl]-2-(1H-indol-3-yl)ethyl]carbamate CAS Name: N-[1-[[5-(4-carbamimidoylphenyl)-3-pyridinyl]oxy]-3-(1H-indol-3-yl)propan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[5-(4-carbamimidoylphenyl)pyridin-3-yl]oxy-3-(1H-indol-3-yl)propan-2-yl]carbamate Traditional Name: N-[1-[[5-(4-amidinophenyl)-3-pyridyl]oxymethyl]-2-(1H-indol-3-yl)ethyl]carbamic acid tert-butyl ester Formula: C28H31N5O3 MolecularWeight: 485.57744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)COC3=CN=CC(=C3)C4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CC(C)(C)OC(=O)NC(CC1=CNC2=CC=CC=C21)COC3=CN=CC(=C3)C4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C28H31N5O3/c1-28(2,3)36-27(34)33-22(12-21-15-32-25-7-5-4-6-24(21)25)17-35-23-13-20(14-31-16-23)18-8-10-19(11-9-18)26(29)30/h4-11,13-16,22,32H,12,17H2,1-3H3,(H3,29,30)(H,33,34)