2-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-(4-dimethylaminophenyl)-2-(4-fluorophenyl)ethanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-(4-dimethylaminophenyl)-2-(4-fluorophenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-(4-dimethylaminophenyl)-2-(4-fluorophenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(phenylmethyl)amino]-N-(4-dimethylaminophenyl)-2-(4-fluorophenyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-benzylamino]-N-(4-dimethylaminophenyl)-2-(4-fluorophenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-(4-dimethylaminophenyl)-2-(4-fluorophenyl)acetamide Formula: C31H29FN6O2 MolecularWeight: 536.599363

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=O)C(C2=CC=C(C=C2)F)N(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=O)C(C2=CC=C(C=C2)F)N(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C31H29FN6O2/c1-36(2)26-18-16-25(17-19-26)33-31(40)30(23-12-14-24(32)15-13-23)37(20-22-8-4-3-5-9-22)29(39)21-38-28-11-7-6-10-27(28)34-35-38/h3-19,30H,20-21H2,1-2H3,(H,33,40)