3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentanenitrile

Systemtic Name: 3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentanenitrile Openeye Name: 3-(4-thiazol-2-ylpiperazin-1-yl)pentanenitrile CAS Name: 3-[4-(2-thiazolyl)-1-piperazinyl]pentanenitrile IUPAC Name: 3-[4-(1,3-thiazol-2-yl)piperazin-1-yl]pentanenitrile Traditional Name: 3-(4-thiazol-2-ylpiperazino)valeronitrile Formula: C12H18N4S MolecularWeight: 250.36312

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC#N)N1CCN(CC1)C2=NC=CS2

Isomeric SMILES

CCC(CC#N)N1CCN(CC1)C2=NC=CS2

InChI

InChI=1S/C12H18N4S/c1-2-11(3-4-13)15-6-8-16(9-7-15)12-14-5-10-17-12/h5,10-11H,2-3,6-9H2,1H3