3-chloranyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-chloranyl-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,2-thiazole-4-carbonitrile Openeye Name: 3-chloro-5-(4-pyrimidin-2-ylpiperazin-1-yl)isothiazole-4-carbonitrile CAS Name: 3-chloro-5-[4-(2-pyrimidinyl)-1-piperazinyl]-4-isothiazolecarbonitrile IUPAC Name: 3-chloro-5-(4-pyrimidin-2-ylpiperazin-1-yl)-1,2-thiazole-4-carbonitrile Traditional Name: 3-chloro-5-[4-(2-pyrimidyl)piperazino]isothiazole-4-carbonitrile Formula: C12H11ClN6S MolecularWeight: 306.77394

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NS2)Cl)C#N)C3=NC=CC=N3

Isomeric SMILES

C1CN(CCN1C2=C(C(=NS2)Cl)C#N)C3=NC=CC=N3

InChI

InChI=1S/C12H11ClN6S/c13-10-9(8-14)11(20-17-10)18-4-6-19(7-5-18)12-15-2-1-3-16-12/h1-3H,4-7H2