[4-[[5-azanyl-1-[(2-fluorophenyl)methyl]indol-2-yl]carbonylamino]phenyl] N-tert-butylcarbamate

Systemtic Name: [4-[[5-azanyl-1-[(2-fluorophenyl)methyl]indol-2-yl]carbonylamino]phenyl] N-tert-butylcarbamate Openeye Name: [4-[[5-amino-1-[(2-fluorophenyl)methyl]indole-2-carbonyl]amino]phenyl] N-tert-butylcarbamate CAS Name: N-tert-butylcarbamic acid [4-[[[5-amino-1-[(2-fluorophenyl)methyl]-2-indolyl]-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[[5-amino-1-[(2-fluorophenyl)methyl]indole-2-carbonyl]amino]phenyl] N-tert-butylcarbamate Traditional Name: N-tert-butylcarbamic acid [4-[[5-amino-1-(2-fluorobenzyl)indole-2-carbonyl]amino]phenyl] ester Formula: C27H27FN4O3 MolecularWeight: 474.526683

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)OC1=CC=C(C=C1)NC(=O)C2=CC3=C(N2CC4=CC=CC=C4F)C=CC(=C3)N

Isomeric SMILES

CC(C)(C)NC(=O)OC1=CC=C(C=C1)NC(=O)C2=CC3=C(N2CC4=CC=CC=C4F)C=CC(=C3)N

InChI

InChI=1S/C27H27FN4O3/c1-27(2,3)31-26(34)35-21-11-9-20(10-12-21)30-25(33)24-15-18-14-19(29)8-13-23(18)32(24)16-17-6-4-5-7-22(17)28/h4-15H,16,29H2,1-3H3,(H,30,33)(H,31,34)