3-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]carbonyl-1-methyl-indazole-6-carbonitrile

Systemtic Name: 3-[4-[2-(4-fluorophenyl)ethyl]piperazin-1-yl]carbonyl-1-methyl-indazole-6-carbonitrile Openeye Name: 3-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1-methyl-indazole-6-carbonitrile CAS Name: 3-[[4-[2-(4-fluorophenyl)ethyl]-1-piperazinyl]-oxomethyl]-1-methyl-6-indazolecarbonitrile IUPAC Name: 3-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1-methylindazole-6-carbonitrile Traditional Name: 3-[4-[2-(4-fluorophenyl)ethyl]piperazine-1-carbonyl]-1-methyl-indazole-6-carbonitrile Formula: C22H22FN5O MolecularWeight: 391.441383

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)C#N)C(=N1)C(=O)N3CCN(CC3)CCC4=CC=C(C=C4)F

Isomeric SMILES

CN1C2=C(C=CC(=C2)C#N)C(=N1)C(=O)N3CCN(CC3)CCC4=CC=C(C=C4)F

InChI

InChI=1S/C22H22FN5O/c1-26-20-14-17(15-24)4-7-19(20)21(25-26)22(29)28-12-10-27(11-13-28)9-8-16-2-5-18(23)6-3-16/h2-7,14H,8-13H2,1H3