[4-(benzotriazol-1-ylmethyl)phenyl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone

Systemtic Name: [4-(benzotriazol-1-ylmethyl)phenyl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Openeye Name: [4-(benzotriazol-1-ylmethyl)phenyl]-[4-(2-thienylsulfonyl)piperazin-1-yl]methanone CAS Name: [4-(1-benzotriazolylmethyl)phenyl]-(4-thiophen-2-ylsulfonyl-1-piperazinyl)methanone IUPAC Name: [4-(benzotriazol-1-ylmethyl)phenyl]-(4-thiophen-2-ylsulfonylpiperazin-1-yl)methanone Traditional Name: [4-(benzotriazol-1-ylmethyl)phenyl]-[4-(2-thienylsulfonyl)piperazino]methanone Formula: C22H21N5O3S2 MolecularWeight: 467.56384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)S(=O)(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3)S(=O)(=O)C5=CC=CS5

InChI

InChI=1S/C22H21N5O3S2/c28-22(25-11-13-26(14-12-25)32(29,30)21-6-3-15-31-21)18-9-7-17(8-10-18)16-27-20-5-2-1-4-19(20)23-24-27/h1-10,15H,11-14,16H2