2-[2-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]ethyl]-3-methyl-4-thiophen-2-yl-butanenitrile

Systemtic Name: 2-[2-[4-[2-(4-fluoranylphenoxy)ethyl]piperazin-1-yl]ethyl]-3-methyl-4-thiophen-2-yl-butanenitrile Openeye Name: 2-[2-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]ethyl]-3-methyl-4-(2-thienyl)butanenitrile CAS Name: 2-[2-[4-[2-(4-fluorophenoxy)ethyl]-1-piperazinyl]ethyl]-3-methyl-4-thiophen-2-ylbutanenitrile IUPAC Name: 2-[2-[4-[2-(4-fluorophenoxy)ethyl]piperazin-1-yl]ethyl]-3-methyl-4-thiophen-2-ylbutanenitrile Traditional Name: 2-[2-[4-[2-(4-fluorophenoxy)ethyl]piperazino]ethyl]-3-methyl-4-(2-thienyl)butyronitrile Formula: C23H30FN3OS MolecularWeight: 415.567203

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CS1)C(CCN2CCN(CC2)CCOC3=CC=C(C=C3)F)C#N

Isomeric SMILES

CC(CC1=CC=CS1)C(CCN2CCN(CC2)CCOC3=CC=C(C=C3)F)C#N

InChI

InChI=1S/C23H30FN3OS/c1-19(17-23-3-2-16-29-23)20(18-25)8-9-26-10-12-27(13-11-26)14-15-28-22-6-4-21(24)5-7-22/h2-7,16,19-20H,8-15,17H2,1H3