2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-5-nitro-pyridine-3-carbonitrile

Systemtic Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-5-nitro-pyridine-3-carbonitrile Openeye Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-5-nitro-pyridine-3-carbonitrile CAS Name: 2-[4-(2-chlorophenyl)sulfonyl-1-piperazinyl]-5-nitro-3-pyridinecarbonitrile IUPAC Name: 2-[4-(2-chlorophenyl)sulfonylpiperazin-1-yl]-5-nitropyridine-3-carbonitrile Traditional Name: 2-[4-(2-chlorophenyl)sulfonylpiperazino]-5-nitro-nicotinonitrile Formula: C16H14ClN5O4S MolecularWeight: 407.83146

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=C(C=C2C#N)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3Cl

Isomeric SMILES

C1CN(CCN1C2=NC=C(C=C2C#N)[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C16H14ClN5O4S/c17-14-3-1-2-4-15(14)27(25,26)21-7-5-20(6-8-21)16-12(10-18)9-13(11-19-16)22(23)24/h1-4,9,11H,5-8H2