2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonylphenyl]benzenecarbonitrile

Systemtic Name: 2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonylphenyl]benzenecarbonitrile Openeye Name: 2-[2-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]phenyl]benzonitrile CAS Name: 2-[2-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]phenyl]benzonitrile IUPAC Name: 2-[2-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)phenyl]benzonitrile Traditional Name: 2-[2-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]phenyl]benzonitrile Formula: C22H19N3O3S2 MolecularWeight: 437.53456

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2C3=CC=CC=C3C#N)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2C3=CC=CC=C3C#N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3O3S2/c23-16-17-6-1-2-7-18(17)19-8-3-4-9-20(19)22(26)24-11-13-25(14-12-24)30(27,28)21-10-5-15-29-21/h1-10,15H,11-14H2