2-[4-[(4-ethylsulfanylphenyl)methyl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[(4-ethylsulfanylphenyl)methyl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[(4-ethylsulfanylphenyl)methyl]piperazin-1-yl]benzonitrile CAS Name: 2-[4-[[4-(ethylthio)phenyl]methyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-[(4-ethylsulfanylphenyl)methyl]piperazin-1-yl]benzonitrile Traditional Name: 2-[4-[4-(ethylthio)benzyl]piperazino]benzonitrile Formula: C20H23N3S MolecularWeight: 337.48172

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC=C3C#N

Isomeric SMILES

CCSC1=CC=C(C=C1)CN2CCN(CC2)C3=CC=CC=C3C#N

InChI

InChI=1S/C20H23N3S/c1-2-24-19-9-7-17(8-10-19)16-22-11-13-23(14-12-22)20-6-4-3-5-18(20)15-21/h3-10H,2,11-14,16H2,1H3