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

Systemtic Name: 4-[4-[5-(4-chlorophenyl)furan-2-yl]carbonylpiperazin-1-yl]sulfonylbenzenecarbonitrile Openeye Name: 4-[4-[5-(4-chlorophenyl)furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile CAS Name: 4-[[4-[[5-(4-chlorophenyl)-2-furanyl]-oxomethyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 4-[4-[5-(4-chlorophenyl)furan-2-carbonyl]piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 4-[4-[5-(4-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=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)C#N

Isomeric SMILES

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

InChI

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