3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzenecarbonitrile

Systemtic Name: 3-(4-thiophen-2-ylcarbonylpiperazin-1-yl)sulfonylbenzenecarbonitrile Openeye Name: 3-[4-(thiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile CAS Name: 3-[[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]sulfonyl]benzonitrile IUPAC Name: 3-[4-(thiophene-2-carbonyl)piperazin-1-yl]sulfonylbenzonitrile Traditional Name: 3-[4-(2-thenoyl)piperazino]sulfonylbenzonitrile Formula: C16H15N3O3S2 MolecularWeight: 361.4386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15N3O3S2/c17-12-13-3-1-4-14(11-13)24(21,22)19-8-6-18(7-9-19)16(20)15-5-2-10-23-15/h1-5,10-11H,6-9H2