N-(4-aminophenyl)-5-(3,3-dimethylpent-4-enoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide

Systemtic Name: N-(4-aminophenyl)-5-(3,3-dimethylpent-4-enoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide Openeye Name: N-(4-aminophenyl)-5-(3,3-dimethylpent-4-enoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide CAS Name: N-(4-aminophenyl)-5-[(3,3-dimethyl-1-oxopent-4-enyl)amino]-1-[(2-fluorophenyl)methyl]-2-indolecarboxamide IUPAC Name: N-(4-aminophenyl)-5-(3,3-dimethylpent-4-enoylamino)-1-[(2-fluorophenyl)methyl]indole-2-carboxamide Traditional Name: N-(4-aminophenyl)-5-(3,3-dimethylpent-4-enoylamino)-1-(2-fluorobenzyl)indole-2-carboxamide Formula: C29H29FN4O2 MolecularWeight: 484.564563

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C29H29FN4O2/c1-4-29(2,3)17-27(35)32-23-13-14-25-20(15-23)16-26(28(36)33-22-11-9-21(31)10-12-22)34(25)18-19-7-5-6-8-24(19)30/h4-16H,1,17-18,31H2,2-3H3,(H,32,35)(H,33,36)