N-(3-fluoranyl-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide

Systemtic Name: N-(3-fluoranyl-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide Openeye Name: N-(3-fluoro-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide CAS Name: N-(3-fluoro-4-methylphenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]-1-piperazinecarboxamide IUPAC Name: N-(3-fluoro-4-methylphenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide Traditional Name: N-(3-fluoro-4-methyl-phenyl)-4-[(6-methyl-1,3-benzoxazol-2-yl)methyl]piperazine-1-carboxamide Formula: C21H23FN4O2 MolecularWeight: 382.431323

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)CN3CCN(CC3)C(=O)NC4=CC(=C(C=C4)C)F

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)CN3CCN(CC3)C(=O)NC4=CC(=C(C=C4)C)F

InChI

InChI=1S/C21H23FN4O2/c1-14-3-6-18-19(11-14)28-20(24-18)13-25-7-9-26(10-8-25)21(27)23-16-5-4-15(2)17(22)12-16/h3-6,11-12H,7-10,13H2,1-2H3,(H,23,27)