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

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-(phenylmethyl)amino]-N-cyclohexyl-2-(4-fluorophenyl)ethanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-cyclohexyl-2-(4-fluorophenyl)acetamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-(phenylmethyl)amino]-N-cyclohexyl-2-(4-fluorophenyl)acetamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-benzylamino]-N-cyclohexyl-2-(4-fluorophenyl)acetamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-benzyl-amino]-N-cyclohexyl-2-(4-fluorophenyl)acetamide Formula: C29H30FN5O2 MolecularWeight: 499.579203

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C(C2=CC=C(C=C2)F)N(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

C1CCC(CC1)NC(=O)C(C2=CC=C(C=C2)F)N(CC3=CC=CC=C3)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H30FN5O2/c30-23-17-15-22(16-18-23)28(29(37)31-24-11-5-2-6-12-24)34(19-21-9-3-1-4-10-21)27(36)20-35-26-14-8-7-13-25(26)32-33-35/h1,3-4,7-10,13-18,24,28H,2,5-6,11-12,19-20H2,(H,31,37)