4-(benzotriazol-1-ylmethyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 4-(benzotriazol-1-ylmethyl)-N-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-fluoroanilino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 4-(1-benzotriazolylmethyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 4-(benzotriazol-1-ylmethyl)-N-[2-(4-fluoroanilino)-2-keto-ethyl]-N-methyl-benzamide Formula: C23H20FN5O2 MolecularWeight: 417.435603

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

CN(CC(=O)NC1=CC=C(C=C1)F)C(=O)C2=CC=C(C=C2)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C23H20FN5O2/c1-28(15-22(30)25-19-12-10-18(24)11-13-19)23(31)17-8-6-16(7-9-17)14-29-21-5-3-2-4-20(21)26-27-29/h2-13H,14-15H2,1H3,(H,25,30)