2-[4-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[4-(3-thienylmethyl)piperazin-1-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[4-(thiophen-3-ylmethyl)piperazin-1-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[[4-(3-thenyl)piperazino]methyl]phenyl]benzonitrile Formula: C23H23N3S MolecularWeight: 373.51382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CC4=CSC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CC4=CSC=C4

InChI

InChI=1S/C23H23N3S/c24-15-22-3-1-2-4-23(22)21-7-5-19(6-8-21)16-25-10-12-26(13-11-25)17-20-9-14-27-18-20/h1-9,14,18H,10-13,16-17H2