4-[1-[3-(dimethylamino)propyl]-5-fluoranyl-indol-3-yl]-3-phenyl-1H-1,2,4-triazol-5-one

Systemtic Name: 4-[1-[3-(dimethylamino)propyl]-5-fluoranyl-indol-3-yl]-3-phenyl-1H-1,2,4-triazol-5-one Openeye Name: 4-[1-[3-(dimethylamino)propyl]-5-fluoro-indol-3-yl]-3-phenyl-1H-1,2,4-triazol-5-one CAS Name: 4-[1-[3-(dimethylamino)propyl]-5-fluoro-3-indolyl]-3-phenyl-1H-1,2,4-triazol-5-one IUPAC Name: 4-[1-[3-(dimethylamino)propyl]-5-fluoroindol-3-yl]-3-phenyl-1H-1,2,4-triazol-5-one Traditional Name: 4-[1-[3-(dimethylamino)propyl]-5-fluoro-indol-3-yl]-3-phenyl-1H-1,2,4-triazol-5-one Formula: C21H22FN5O MolecularWeight: 379.430683

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C=C(C2=C1C=CC(=C2)F)N3C(=NNC3=O)C4=CC=CC=C4

Isomeric SMILES

CN(C)CCCN1C=C(C2=C1C=CC(=C2)F)N3C(=NNC3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22FN5O/c1-25(2)11-6-12-26-14-19(17-13-16(22)9-10-18(17)26)27-20(23-24-21(27)28)15-7-4-3-5-8-15/h3-5,7-10,13-14H,6,11-12H2,1-2H3,(H,24,28)