2-[2-(benzotriazol-1-yl)ethanoyl-[(2-fluorophenyl)methyl]amino]-2-methyl-N-(4-morpholin-4-ylphenyl)propanamide

Systemtic Name: 2-[2-(benzotriazol-1-yl)ethanoyl-[(2-fluorophenyl)methyl]amino]-2-methyl-N-(4-morpholin-4-ylphenyl)propanamide Openeye Name: 2-[[2-(benzotriazol-1-yl)acetyl]-[(2-fluorophenyl)methyl]amino]-2-methyl-N-(4-morpholinophenyl)propanamide CAS Name: 2-[[2-(1-benzotriazolyl)-1-oxoethyl]-[(2-fluorophenyl)methyl]amino]-2-methyl-N-[4-(4-morpholinyl)phenyl]propanamide IUPAC Name: 2-[[2-(benzotriazol-1-yl)acetyl]-[(2-fluorophenyl)methyl]amino]-2-methyl-N-(4-morpholin-4-ylphenyl)propanamide Traditional Name: 2-[[2-(benzotriazol-1-yl)acetyl]-(2-fluorobenzyl)amino]-2-methyl-N-(4-morpholinophenyl)propionamide Formula: C29H31FN6O3 MolecularWeight: 530.593243

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC=C(C=C1)N2CCOCC2)N(CC3=CC=CC=C3F)C(=O)CN4C5=CC=CC=C5N=N4

Isomeric SMILES

CC(C)(C(=O)NC1=CC=C(C=C1)N2CCOCC2)N(CC3=CC=CC=C3F)C(=O)CN4C5=CC=CC=C5N=N4

InChI

InChI=1S/C29H31FN6O3/c1-29(2,28(38)31-22-11-13-23(14-12-22)34-15-17-39-18-16-34)35(19-21-7-3-4-8-24(21)30)27(37)20-36-26-10-6-5-9-25(26)32-33-36/h3-14H,15-20H2,1-2H3,(H,31,38)