N-[(4-fluorophenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide

Systemtic Name: N-[(4-fluorophenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxy-ethanamide Openeye Name: N-[(4-fluorophenyl)methyl]-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-acetamide CAS Name: N-[(4-fluorophenyl)methyl]-2-[[6-(4-morpholinylsulfonyl)-1-benzotriazolyl]oxy]acetamide IUPAC Name: N-[(4-fluorophenyl)methyl]-2-(6-morpholin-4-ylsulfonylbenzotriazol-1-yl)oxyacetamide Traditional Name: N-(4-fluorobenzyl)-2-(6-morpholinosulfonylbenzotriazol-1-yl)oxy-acetamide Formula: C19H20FN5O5S MolecularWeight: 449.456003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC=C(C=C4)F

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC3=C(C=C2)N=NN3OCC(=O)NCC4=CC=C(C=C4)F

InChI

InChI=1S/C19H20FN5O5S/c20-15-3-1-14(2-4-15)12-21-19(26)13-30-25-18-11-16(5-6-17(18)22-23-25)31(27,28)24-7-9-29-10-8-24/h1-6,11H,7-10,12-13H2,(H,21,26)