4-butyl-N-[2-[3-[(4-fluorophenyl)methyl]imidazol-4-yl]ethyl]-1-methylsulfonyl-piperazine-2-carboxamide

Systemtic Name: 4-butyl-N-[2-[3-[(4-fluorophenyl)methyl]imidazol-4-yl]ethyl]-1-methylsulfonyl-piperazine-2-carboxamide Openeye Name: 4-butyl-N-[2-[3-[(4-fluorophenyl)methyl]imidazol-4-yl]ethyl]-1-methylsulfonyl-piperazine-2-carboxamide CAS Name: 4-butyl-N-[2-[3-[(4-fluorophenyl)methyl]-4-imidazolyl]ethyl]-1-methylsulfonyl-2-piperazinecarboxamide IUPAC Name: 4-butyl-N-[2-[3-[(4-fluorophenyl)methyl]imidazol-4-yl]ethyl]-1-methylsulfonylpiperazine-2-carboxamide Traditional Name: 4-butyl-N-[2-[3-(4-fluorobenzyl)imidazol-4-yl]ethyl]-1-mesyl-piperazine-2-carboxamide Formula: C22H32FN5O3S MolecularWeight: 465.584583

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)F)S(=O)(=O)C

Isomeric SMILES

CCCCN1CCN(C(C1)C(=O)NCCC2=CN=CN2CC3=CC=C(C=C3)F)S(=O)(=O)C

InChI

InChI=1S/C22H32FN5O3S/c1-3-4-11-26-12-13-28(32(2,30)31)21(16-26)22(29)25-10-9-20-14-24-17-27(20)15-18-5-7-19(23)8-6-18/h5-8,14,17,21H,3-4,9-13,15-16H2,1-2H3,(H,25,29)