3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]propanenitrile

Systemtic Name: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]propanenitrile Openeye Name: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]propanenitrile CAS Name: 3-[4-(1,3-benzothiazol-2-yl)-1-piperazinyl]propanenitrile IUPAC Name: 3-[4-(1,3-benzothiazol-2-yl)piperazin-1-yl]propanenitrile Traditional Name: 3-[4-(1,3-benzothiazol-2-yl)piperazino]propionitrile Formula: C14H16N4S MolecularWeight: 272.36864

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC#N)C2=NC3=CC=CC=C3S2

Isomeric SMILES

C1CN(CCN1CCC#N)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C14H16N4S/c15-6-3-7-17-8-10-18(11-9-17)14-16-12-4-1-2-5-13(12)19-14/h1-2,4-5H,3,7-11H2