2-[2-[4-(3-cyano-4-methyl-3-thiophen-2-yl-pentyl)piperazin-1-yl]ethyl]-3-methyl-2-thiophen-2-yl-butanenitrile

Systemtic Name: 2-[2-[4-(3-cyano-4-methyl-3-thiophen-2-yl-pentyl)piperazin-1-yl]ethyl]-3-methyl-2-thiophen-2-yl-butanenitrile Openeye Name: 2-[2-[4-[3-cyano-4-methyl-3-(2-thienyl)pentyl]piperazin-1-yl]ethyl]-3-methyl-2-(2-thienyl)butanenitrile CAS Name: 2-[2-[4-(3-cyano-4-methyl-3-thiophen-2-ylpentyl)-1-piperazinyl]ethyl]-3-methyl-2-thiophen-2-ylbutanenitrile IUPAC Name: 2-[2-[4-(3-cyano-4-methyl-3-thiophen-2-ylpentyl)piperazin-1-yl]ethyl]-3-methyl-2-thiophen-2-ylbutanenitrile Traditional Name: 2-[2-[4-[3-cyano-4-methyl-3-(2-thienyl)pentyl]piperazino]ethyl]-3-methyl-2-(2-thienyl)butyronitrile Formula: C26H36N4S2 MolecularWeight: 468.72084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CCN1CCN(CC1)CCC(C#N)(C2=CC=CS2)C(C)C)(C#N)C3=CC=CS3

Isomeric SMILES

CC(C)C(CCN1CCN(CC1)CCC(C#N)(C2=CC=CS2)C(C)C)(C#N)C3=CC=CS3

InChI

InChI=1S/C26H36N4S2/c1-21(2)25(19-27,23-7-5-17-31-23)9-11-29-13-15-30(16-14-29)12-10-26(20-28,22(3)4)24-8-6-18-32-24/h5-8,17-18,21-22H,9-16H2,1-4H3