4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzonitrile CAS Name: 4-[[4-(3-chlorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-(3-chlorophenyl)sulfonylpiperazine-1-carbonyl]benzonitrile Formula: C18H16ClN3O3S MolecularWeight: 389.85594

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16ClN3O3S/c19-16-2-1-3-17(12-16)26(24,25)22-10-8-21(9-11-22)18(23)15-6-4-14(13-20)5-7-15/h1-7,12H,8-11H2