6-[2-[4-(4-cyano-5-methyl-4-thiophen-2-yl-hexyl)piperazin-1-yl]ethoxy]pyridine-2-carbonitrile

Systemtic Name: 6-[2-[4-(4-cyano-5-methyl-4-thiophen-2-yl-hexyl)piperazin-1-yl]ethoxy]pyridine-2-carbonitrile Openeye Name: 6-[2-[4-[4-cyano-5-methyl-4-(2-thienyl)hexyl]piperazin-1-yl]ethoxy]pyridine-2-carbonitrile CAS Name: 6-[2-[4-(4-cyano-5-methyl-4-thiophen-2-ylhexyl)-1-piperazinyl]ethoxy]-2-pyridinecarbonitrile IUPAC Name: 6-[2-[4-(4-cyano-5-methyl-4-thiophen-2-ylhexyl)piperazin-1-yl]ethoxy]pyridine-2-carbonitrile Traditional Name: 6-[2-[4-[4-cyano-5-methyl-4-(2-thienyl)hexyl]piperazino]ethoxy]picolinonitrile Formula: C24H31N5OS MolecularWeight: 437.60084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=CC(=N2)C#N)(C#N)C3=CC=CS3

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CCOC2=CC=CC(=N2)C#N)(C#N)C3=CC=CS3

InChI

InChI=1S/C24H31N5OS/c1-20(2)24(19-26,22-7-4-17-31-22)9-5-10-28-11-13-29(14-12-28)15-16-30-23-8-3-6-21(18-25)27-23/h3-4,6-8,17,20H,5,9-16H2,1-2H3