N-[4-(1-ethylindol-3-yl)butan-2-yl]-1-(4-fluorophenyl)-5-phenyl-1,2,3-triazole-4-carboxamide

Systemtic Name: N-[4-(1-ethylindol-3-yl)butan-2-yl]-1-(4-fluorophenyl)-5-phenyl-1,2,3-triazole-4-carboxamide Openeye Name: N-[3-(1-ethylindol-3-yl)-1-methyl-propyl]-1-(4-fluorophenyl)-5-phenyl-triazole-4-carboxamide CAS Name: N-[4-(1-ethyl-3-indolyl)butan-2-yl]-1-(4-fluorophenyl)-5-phenyl-4-triazolecarboxamide IUPAC Name: N-[4-(1-ethylindol-3-yl)butan-2-yl]-1-(4-fluorophenyl)-5-phenyltriazole-4-carboxamide Traditional Name: N-[3-(1-ethylindol-3-yl)-1-methyl-propyl]-1-(4-fluorophenyl)-5-phenyl-triazole-4-carboxamide Formula: C29H28FN5O MolecularWeight: 481.563923

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C2=CC=CC=C21)CCC(C)NC(=O)C3=C(N(N=N3)C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CCN1C=C(C2=CC=CC=C21)CCC(C)NC(=O)C3=C(N(N=N3)C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C29H28FN5O/c1-3-34-19-22(25-11-7-8-12-26(25)34)14-13-20(2)31-29(36)27-28(21-9-5-4-6-10-21)35(33-32-27)24-17-15-23(30)16-18-24/h4-12,15-20H,3,13-14H2,1-2H3,(H,31,36)