2-(benzotriazol-1-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[4-(2-thienylsulfonyl)piperazin-1-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-(4-thiophen-2-ylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-(4-thiophen-2-ylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[4-(2-thienylsulfonyl)piperazino]ethanone Formula: C16H17N5O3S2 MolecularWeight: 391.46788

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CN2C3=CC=CC=C3N=N2)S(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(CCN1C(=O)CN2C3=CC=CC=C3N=N2)S(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C16H17N5O3S2/c22-15(12-21-14-5-2-1-4-13(14)17-18-21)19-7-9-20(10-8-19)26(23,24)16-6-3-11-25-16/h1-6,11H,7-10,12H2