N-(5-azanylpyridin-2-yl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide

Systemtic Name: N-(5-azanylpyridin-2-yl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide Openeye Name: N-(5-amino-2-pyridyl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide CAS Name: N-(5-amino-2-pyridinyl)-5-[(3,3-dimethyl-1-oxobutyl)amino]-1-[(2-fluorophenyl)methyl]-2-indolecarboxamide IUPAC Name: N-(5-aminopyridin-2-yl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide Traditional Name: N-(5-amino-2-pyridyl)-5-(3,3-dimethylbutanoylamino)-1-(2-fluorobenzyl)indole-2-carboxamide Formula: C27H28FN5O2 MolecularWeight: 473.541923

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)NC1=CC2=C(C=C1)N(C(=C2)C(=O)NC3=NC=C(C=C3)N)CC4=CC=CC=C4F

Isomeric SMILES

CC(C)(C)CC(=O)NC1=CC2=C(C=C1)N(C(=C2)C(=O)NC3=NC=C(C=C3)N)CC4=CC=CC=C4F

InChI

InChI=1S/C27H28FN5O2/c1-27(2,3)14-25(34)31-20-9-10-22-18(12-20)13-23(26(35)32-24-11-8-19(29)15-30-24)33(22)16-17-6-4-5-7-21(17)28/h4-13,15H,14,16,29H2,1-3H3,(H,31,34)(H,30,32,35)