(1-ethylbenzotriazol-5-yl)-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone

Systemtic Name: (1-ethylbenzotriazol-5-yl)-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone Openeye Name: (1-ethylbenzotriazol-5-yl)-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone CAS Name: (1-ethyl-5-benzotriazolyl)-[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]methanone IUPAC Name: (1-ethylbenzotriazol-5-yl)-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]methanone Traditional Name: (1-ethylbenzotriazol-5-yl)-[4-(2-fluorophenyl)sulfonylpiperazino]methanone Formula: C19H20FN5O3S MolecularWeight: 417.457203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)S(=O)(=O)C4=CC=CC=C4F)N=N1

InChI

InChI=1S/C19H20FN5O3S/c1-2-25-17-8-7-14(13-16(17)21-22-25)19(26)23-9-11-24(12-10-23)29(27,28)18-6-4-3-5-15(18)20/h3-8,13H,2,9-12H2,1H3