3-bromanyl-5-[4-(phenylcarbonyl)piperazin-1-yl]-1,2-thiazole-4-carbonitrile

Systemtic Name: 3-bromanyl-5-[4-(phenylcarbonyl)piperazin-1-yl]-1,2-thiazole-4-carbonitrile Openeye Name: 5-(4-benzoylpiperazin-1-yl)-3-bromo-isothiazole-4-carbonitrile CAS Name: 5-(4-benzoyl-1-piperazinyl)-3-bromo-4-isothiazolecarbonitrile IUPAC Name: 5-(4-benzoylpiperazin-1-yl)-3-bromo-1,2-thiazole-4-carbonitrile Traditional Name: 5-(4-benzoylpiperazino)-3-bromo-isothiazole-4-carbonitrile Formula: C15H13BrN4OS MolecularWeight: 377.25892

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=NS2)Br)C#N)C(=O)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1C2=C(C(=NS2)Br)C#N)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C15H13BrN4OS/c16-13-12(10-17)15(22-18-13)20-8-6-19(7-9-20)14(21)11-4-2-1-3-5-11/h1-5H,6-9H2