4-[3-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[3-[4-[(5-chloranylthiophen-2-yl)methyl]piperazin-1-yl]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[3-[4-[(5-chloro-2-thienyl)methyl]piperazin-1-yl]-2-hydroxy-propoxy]benzonitrile CAS Name: 4-[3-[4-[(5-chloro-2-thiophenyl)methyl]-1-piperazinyl]-2-hydroxypropoxy]benzonitrile IUPAC Name: 4-[3-[4-[(5-chlorothiophen-2-yl)methyl]piperazin-1-yl]-2-hydroxypropoxy]benzonitrile Traditional Name: 4-[3-[4-[(5-chloro-2-thienyl)methyl]piperazino]-2-hydroxy-propoxy]benzonitrile Formula: C19H22ClN3O2S MolecularWeight: 391.91488

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(S2)Cl)CC(COC3=CC=C(C=C3)C#N)O

Isomeric SMILES

C1CN(CCN1CC2=CC=C(S2)Cl)CC(COC3=CC=C(C=C3)C#N)O

InChI

InChI=1S/C19H22ClN3O2S/c20-19-6-5-18(26-19)13-23-9-7-22(8-10-23)12-16(24)14-25-17-3-1-15(11-21)2-4-17/h1-6,16,24H,7-10,12-14H2