N-[[4-fluoranyl-3-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[[4-fluoranyl-3-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[[4-fluoro-3-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-(1-piperidylsulfonyl)benzamide CAS Name: N-[[4-fluoro-3-(1-imidazolylmethyl)phenyl]methyl]-2-methyl-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[[4-fluoro-3-(imidazol-1-ylmethyl)phenyl]methyl]-2-methyl-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[4-fluoro-3-(imidazol-1-ylmethyl)benzyl]-2-methyl-5-piperidinosulfonyl-benzamide Formula: C24H27FN4O3S MolecularWeight: 470.559583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=CC(=C(C=C3)F)CN4C=CN=C4

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)C(=O)NCC3=CC(=C(C=C3)F)CN4C=CN=C4

InChI

InChI=1S/C24H27FN4O3S/c1-18-5-7-21(33(31,32)29-10-3-2-4-11-29)14-22(18)24(30)27-15-19-6-8-23(25)20(13-19)16-28-12-9-26-17-28/h5-9,12-14,17H,2-4,10-11,15-16H2,1H3,(H,27,30)