N-[(2-fluorophenyl)methyl]-4-[(2R)-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]piperazine-1-carboxamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-4-[(2R)-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]-2-oxidanyl-propyl]piperazine-1-carboxamide Openeye Name: N-[(2-fluorophenyl)methyl]-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]piperazine-1-carboxamide CAS Name: N-[(2-fluorophenyl)methyl]-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]-1-piperazinecarboxamide IUPAC Name: N-[(2-fluorophenyl)methyl]-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]piperazine-1-carboxamide Traditional Name: N-(2-fluorobenzyl)-4-[(2R)-2-hydroxy-3-[(2-methyl-1,3-benzothiazol-5-yl)oxy]propyl]piperazine-1-carboxamide Formula: C23H27FN4O3S MolecularWeight: 458.548883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=CC(=C2)OCC(CN3CCN(CC3)C(=O)NCC4=CC=CC=C4F)O

Isomeric SMILES

CC1=NC2=C(S1)C=CC(=C2)OC[C@@H](CN3CCN(CC3)C(=O)NCC4=CC=CC=C4F)O

InChI

InChI=1S/C23H27FN4O3S/c1-16-26-21-12-19(6-7-22(21)32-16)31-15-18(29)14-27-8-10-28(11-9-27)23(30)25-13-17-4-2-3-5-20(17)24/h2-7,12,18,29H,8-11,13-15H2,1H3,(H,25,30)/t18-/m1/s1