(2S)-2-(4-fluorophenyl)-2-[4-(5-methylthiophen-2-yl)carbonylpiperazin-1-yl]ethanenitrile

Systemtic Name: (2S)-2-(4-fluorophenyl)-2-[4-(5-methylthiophen-2-yl)carbonylpiperazin-1-yl]ethanenitrile Openeye Name: (2S)-2-(4-fluorophenyl)-2-[4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]acetonitrile CAS Name: (2S)-2-(4-fluorophenyl)-2-[4-[(5-methyl-2-thiophenyl)-oxomethyl]-1-piperazinyl]acetonitrile IUPAC Name: (2S)-2-(4-fluorophenyl)-2-[4-(5-methylthiophene-2-carbonyl)piperazin-1-yl]acetonitrile Traditional Name: (2S)-2-(4-fluorophenyl)-2-[4-(5-methylthiophene-2-carbonyl)piperazino]acetonitrile Formula: C18H18FN3OS MolecularWeight: 343.418423

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)C(=O)N2CCN(CC2)C(C#N)C3=CC=C(C=C3)F

Isomeric SMILES

CC1=CC=C(S1)C(=O)N2CCN(CC2)[C@H](C#N)C3=CC=C(C=C3)F

InChI

InChI=1S/C18H18FN3OS/c1-13-2-7-17(24-13)18(23)22-10-8-21(9-11-22)16(12-20)14-3-5-15(19)6-4-14/h2-7,16H,8-11H2,1H3/t16-/m1/s1