N1'-(1-cyanoethyl)-5-ethyl-6-fluoranyl-6-(1H-indol-3-yl)cyclohexa-2,4-diene-1,1-dicarboxamide

Systemtic Name: N1'-(1-cyanoethyl)-5-ethyl-6-fluoranyl-6-(1H-indol-3-yl)cyclohexa-2,4-diene-1,1-dicarboxamide Openeye Name: N1'-(1-cyanoethyl)-5-ethyl-6-fluoro-6-(1H-indol-3-yl)cyclohexa-2,4-diene-1,1-dicarboxamide CAS Name: N1'-(1-cyanoethyl)-5-ethyl-6-fluoro-6-(1H-indol-3-yl)cyclohexa-2,4-diene-1,1-dicarboxamide IUPAC Name: 1-N'-(1-cyanoethyl)-5-ethyl-6-fluoro-6-(1H-indol-3-yl)cyclohexa-2,4-diene-1,1-dicarboxamide Traditional Name: N'-(1-cyanoethyl)-5-ethyl-6-fluoro-6-(1H-indol-3-yl)cyclohexa-2,4-diene-1,1-dicarboxamide Formula: C21H21FN4O2 MolecularWeight: 380.415443

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(C1(C2=CNC3=CC=CC=C32)F)(C(=O)N)C(=O)NC(C)C#N

Isomeric SMILES

CCC1=CC=CC(C1(C2=CNC3=CC=CC=C32)F)(C(=O)N)C(=O)NC(C)C#N

InChI

InChI=1S/C21H21FN4O2/c1-3-14-7-6-10-20(18(24)27,19(28)26-13(2)11-23)21(14,22)16-12-25-17-9-5-4-8-15(16)17/h4-10,12-13,25H,3H2,1-2H3,(H2,24,27)(H,26,28)