N-(6-azanylpyridin-3-yl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide

Systemtic Name: N-(6-azanylpyridin-3-yl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide Openeye Name: N-(6-amino-3-pyridyl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide CAS Name: N-(6-amino-3-pyridinyl)-5-[(3,3-dimethyl-1-oxobutyl)amino]-1-[(2-fluorophenyl)methyl]-2-indolecarboxamide IUPAC Name: N-(6-aminopyridin-3-yl)-5-(3,3-dimethylbutanoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide Traditional Name: N-(6-amino-3-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=CN=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=CN=C(C=C3)N)CC4=CC=CC=C4F

InChI

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