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

Systemtic Name: 2-[2-(4-thiophen-2-ylsulfonylpiperazin-1-yl)carbonylphenyl]sulfanylbenzenecarbonitrile Openeye Name: 2-[2-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]phenyl]sulfanylbenzonitrile CAS Name: 2-[[2-[oxo-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methyl]phenyl]thio]benzonitrile IUPAC Name: 2-[2-(4-thiophen-2-ylsulfonylpiperazine-1-carbonyl)phenyl]sulfanylbenzonitrile Traditional Name: 2-[[2-[4-(2-thienylsulfonyl)piperazine-1-carbonyl]phenyl]thio]benzonitrile Formula: C22H19N3O3S3 MolecularWeight: 469.59956

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C22H19N3O3S3/c23-16-17-6-1-3-8-19(17)30-20-9-4-2-7-18(20)22(26)24-11-13-25(14-12-24)31(27,28)21-10-5-15-29-21/h1-10,15H,11-14H2