3-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]pyrazine-2-carbonitrile

Systemtic Name: 3-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]pyrazine-2-carbonitrile Openeye Name: 3-[4-(4-chlorobenzoyl)piperazin-1-yl]pyrazine-2-carbonitrile CAS Name: 3-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-2-pyrazinecarbonitrile IUPAC Name: 3-[4-(4-chlorobenzoyl)piperazin-1-yl]pyrazine-2-carbonitrile Traditional Name: 3-[4-(4-chlorobenzoyl)piperazino]pyrazinonitrile Formula: C16H14ClN5O MolecularWeight: 327.76826

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CN=C2C#N)C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CN=C2C#N)C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H14ClN5O/c17-13-3-1-12(2-4-13)16(23)22-9-7-21(8-10-22)15-14(11-18)19-5-6-20-15/h1-6H,7-10H2