2-[4-[5-(2-chlorophenyl)furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile

Systemtic Name: 2-[4-[5-(2-chlorophenyl)furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 2-[4-[5-(2-chlorophenyl)furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 2-[[4-[[5-(2-chlorophenyl)-2-furanyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 2-[4-[5-(2-chlorophenyl)furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 2-[4-[5-(2-chlorophenyl)-2-furoyl]piperazino]sulfonylbenzonitrile Formula: C22H18ClN3O4S MolecularWeight: 455.91402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(O2)C3=CC=CC=C3Cl)S(=O)(=O)C4=CC=CC=C4C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(O2)C3=CC=CC=C3Cl)S(=O)(=O)C4=CC=CC=C4C#N

InChI

InChI=1S/C22H18ClN3O4S/c23-18-7-3-2-6-17(18)19-9-10-20(30-19)22(27)25-11-13-26(14-12-25)31(28,29)21-8-4-1-5-16(21)15-24/h1-10H,11-14H2