2-(4-fluorophenyl)-2-[4-[(3-methyl-1,2-oxazol-5-yl)carbonyl]piperazin-1-yl]ethanenitrile

Systemtic Name: 2-(4-fluorophenyl)-2-[4-[(3-methyl-1,2-oxazol-5-yl)carbonyl]piperazin-1-yl]ethanenitrile Openeye Name: 2-(4-fluorophenyl)-2-[4-(3-methylisoxazole-5-carbonyl)piperazin-1-yl]acetonitrile CAS Name: 2-(4-fluorophenyl)-2-[4-[(3-methyl-5-isoxazolyl)-oxomethyl]-1-piperazinyl]acetonitrile IUPAC Name: 2-(4-fluorophenyl)-2-[4-(3-methyl-1,2-oxazole-5-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: 2-(4-fluorophenyl)-2-[4-(3-methylisoxazole-5-carbonyl)piperazino]acetonitrile Formula: C17H17FN4O2 MolecularWeight: 328.340883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=NOC(=C1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C17H17FN4O2/c1-12-10-16(24-20-12)17(23)22-8-6-21(7-9-22)15(11-19)13-2-4-14(18)5-3-13/h2-5,10,15H,6-9H2,1H3