4-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)sulfonylmethyl]benzenecarbonitrile

Systemtic Name: 4-[(4-thiophen-2-ylcarbonylpiperazin-1-yl)sulfonylmethyl]benzenecarbonitrile Openeye Name: 4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]sulfonylmethyl]benzonitrile CAS Name: 4-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]sulfonylmethyl]benzonitrile IUPAC Name: 4-[[4-(thiophene-2-carbonyl)piperazin-1-yl]sulfonylmethyl]benzonitrile Traditional Name: 4-[[4-(2-thenoyl)piperazino]sulfonylmethyl]benzonitrile Formula: C17H17N3O3S2 MolecularWeight: 375.46518

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=CS2)S(=O)(=O)CC3=CC=C(C=C3)C#N

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=CS2)S(=O)(=O)CC3=CC=C(C=C3)C#N

InChI

InChI=1S/C17H17N3O3S2/c18-12-14-3-5-15(6-4-14)13-25(22,23)20-9-7-19(8-10-20)17(21)16-2-1-11-24-16/h1-6,11H,7-10,13H2