3-[4-(4-methyl-4-phenyl-pentanethioyl)piperazin-1-yl]propanenitrile

Systemtic Name: 3-[4-(4-methyl-4-phenyl-pentanethioyl)piperazin-1-yl]propanenitrile Openeye Name: 3-[4-(4-methyl-4-phenyl-pentanethioyl)piperazin-1-yl]propanenitrile CAS Name: 3-[4-(4-methyl-4-phenyl-1-sulfanylidenepentyl)-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-(4-methyl-4-phenylpentanethioyl)piperazin-1-yl]propanenitrile Traditional Name: 3-[4-(4-methyl-4-phenyl-pentanethioyl)piperazino]propionitrile Formula: C19H27N3S MolecularWeight: 329.50278

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=S)N1CCN(CC1)CCC#N)C2=CC=CC=C2

Isomeric SMILES

CC(C)(CCC(=S)N1CCN(CC1)CCC#N)C2=CC=CC=C2

InChI

InChI=1S/C19H27N3S/c1-19(2,17-7-4-3-5-8-17)10-9-18(23)22-15-13-21(14-16-22)12-6-11-20/h3-5,7-8H,6,9-10,12-16H2,1-2H3