(1-ethylbenzotriazol-5-yl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone

Systemtic Name: (1-ethylbenzotriazol-5-yl)-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone Openeye Name: (1-ethylbenzotriazol-5-yl)-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazin-1-yl]methanone CAS Name: (1-ethyl-5-benzotriazolyl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]methanone IUPAC Name: (1-ethylbenzotriazol-5-yl)-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]methanone Traditional Name: (1-ethylbenzotriazol-5-yl)-[4-(3-fluoro-4-methoxy-benzyl)piperazino]methanone Formula: C21H24FN5O2 MolecularWeight: 397.445963

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC(=C(C=C4)OC)F)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N3CCN(CC3)CC4=CC(=C(C=C4)OC)F)N=N1

InChI

InChI=1S/C21H24FN5O2/c1-3-27-19-6-5-16(13-18(19)23-24-27)21(28)26-10-8-25(9-11-26)14-15-4-7-20(29-2)17(22)12-15/h4-7,12-13H,3,8-11,14H2,1-2H3