N-cyclohexyl-1-ethyl-N-[(4-fluorophenyl)methyl]benzotriazole-5-carboxamide

Systemtic Name: N-cyclohexyl-1-ethyl-N-[(4-fluorophenyl)methyl]benzotriazole-5-carboxamide Openeye Name: N-cyclohexyl-1-ethyl-N-[(4-fluorophenyl)methyl]benzotriazole-5-carboxamide CAS Name: N-cyclohexyl-1-ethyl-N-[(4-fluorophenyl)methyl]-5-benzotriazolecarboxamide IUPAC Name: N-cyclohexyl-1-ethyl-N-[(4-fluorophenyl)methyl]benzotriazole-5-carboxamide Traditional Name: N-cyclohexyl-1-ethyl-N-(4-fluorobenzyl)benzotriazole-5-carboxamide Formula: C22H25FN4O MolecularWeight: 380.458503

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)C(=O)N(CC3=CC=C(C=C3)F)C4CCCCC4)N=N1

Isomeric SMILES

CCN1C2=C(C=C(C=C2)C(=O)N(CC3=CC=C(C=C3)F)C4CCCCC4)N=N1

InChI

InChI=1S/C22H25FN4O/c1-2-27-21-13-10-17(14-20(21)24-25-27)22(28)26(19-6-4-3-5-7-19)15-16-8-11-18(23)12-9-16/h8-14,19H,2-7,15H2,1H3