4-[4-(2-chloranylpyridin-4-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 4-[4-(2-chloranylpyridin-4-yl)carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-(2-chloropyridine-4-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[(2-chloro-4-pyridinyl)-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-(2-chloropyridine-4-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-(2-chloroisonicotinoyl)piperazino]sulfonylbenzonitrile Formula: C17H15ClN4O3S MolecularWeight: 390.844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC(=NC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC(=NC=C2)Cl)S(=O)(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H15ClN4O3S/c18-16-11-14(5-6-20-16)17(23)21-7-9-22(10-8-21)26(24,25)15-3-1-13(12-19)2-4-15/h1-6,11H,7-10H2