4-(4-ethylpiperazin-1-yl)-2-(1-fluoranylpropyl)-6-(2-methylphenyl)benzenecarbonitrile

Systemtic Name: 4-(4-ethylpiperazin-1-yl)-2-(1-fluoranylpropyl)-6-(2-methylphenyl)benzenecarbonitrile Openeye Name: 4-(4-ethylpiperazin-1-yl)-2-(1-fluoropropyl)-6-(o-tolyl)benzonitrile CAS Name: 4-(4-ethyl-1-piperazinyl)-2-(1-fluoropropyl)-6-(2-methylphenyl)benzonitrile IUPAC Name: 4-(4-ethylpiperazin-1-yl)-2-(1-fluoropropyl)-6-(2-methylphenyl)benzonitrile Traditional Name: 4-(4-ethylpiperazino)-2-(1-fluoropropyl)-6-(o-tolyl)benzonitrile Formula: C23H28FN3 MolecularWeight: 365.486923

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=C(C(=CC(=C1)N2CCN(CC2)CC)C3=CC=CC=C3C)C#N)F

Isomeric SMILES

CCC(C1=C(C(=CC(=C1)N2CCN(CC2)CC)C3=CC=CC=C3C)C#N)F

InChI

InChI=1S/C23H28FN3/c1-4-23(24)21-15-18(27-12-10-26(5-2)11-13-27)14-20(22(21)16-25)19-9-7-6-8-17(19)3/h6-9,14-15,23H,4-5,10-13H2,1-3H3