5-[[4-[4-(1-benzothiophen-3-yl)-4-cyano-5-methyl-hexyl]piperazin-1-yl]methyl]thiophene-3-carbonitrile

Systemtic Name: 5-[[4-[4-(1-benzothiophen-3-yl)-4-cyano-5-methyl-hexyl]piperazin-1-yl]methyl]thiophene-3-carbonitrile Openeye Name: 5-[[4-[4-(benzothiophen-3-yl)-4-cyano-5-methyl-hexyl]piperazin-1-yl]methyl]thiophene-3-carbonitrile CAS Name: 5-[[4-[4-(1-benzothiophen-3-yl)-4-cyano-5-methylhexyl]-1-piperazinyl]methyl]-3-thiophenecarbonitrile IUPAC Name: 5-[[4-[4-(1-benzothiophen-3-yl)-4-cyano-5-methylhexyl]piperazin-1-yl]methyl]thiophene-3-carbonitrile Traditional Name: 5-[[4-[4-(benzothiophen-3-yl)-4-cyano-5-methyl-hexyl]piperazino]methyl]thiophene-3-carbonitrile Formula: C26H30N4S2 MolecularWeight: 462.6732

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCCN1CCN(CC1)CC2=CC(=CS2)C#N)(C#N)C3=CSC4=CC=CC=C43

Isomeric SMILES

CC(C)C(CCCN1CCN(CC1)CC2=CC(=CS2)C#N)(C#N)C3=CSC4=CC=CC=C43

InChI

InChI=1S/C26H30N4S2/c1-20(2)26(19-28,24-18-32-25-7-4-3-6-23(24)25)8-5-9-29-10-12-30(13-11-29)16-22-14-21(15-27)17-31-22/h3-4,6-7,14,17-18,20H,5,8-13,16H2,1-2H3