4-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[4-(5-bromanylthiophen-2-yl)sulfonylpiperazin-1-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carbonyl]benzonitrile CAS Name: 4-[[4-[(5-bromo-2-thiophenyl)sulfonyl]-1-piperazinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[4-(5-bromothiophen-2-yl)sulfonylpiperazine-1-carbonyl]benzonitrile Traditional Name: 4-[4-[(5-bromo-2-thienyl)sulfonyl]piperazine-1-carbonyl]benzonitrile Formula: C16H14BrN3O3S2 MolecularWeight: 440.33466

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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=C(S3)Br

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)C#N)S(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C16H14BrN3O3S2/c17-14-5-6-15(24-14)25(22,23)20-9-7-19(8-10-20)16(21)13-3-1-12(11-18)2-4-13/h1-6H,7-10H2