N-[[3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine

Systemtic Name: N-[[3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-imidazol-4-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine Openeye Name: N-[[3-[(2-fluorophenyl)methyl]-2-isopropylsulfonyl-imidazol-4-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine CAS Name: N-[[3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonyl-4-imidazolyl]methyl]-N-methyl-2-(1-methyl-4-pyrazolyl)ethanamine IUPAC Name: N-[[3-[(2-fluorophenyl)methyl]-2-propan-2-ylsulfonylimidazol-4-yl]methyl]-N-methyl-2-(1-methylpyrazol-4-yl)ethanamine Traditional Name: [3-(2-fluorobenzyl)-2-isopropylsulfonyl-imidazol-4-yl]methyl-methyl-[2-(1-methylpyrazol-4-yl)ethyl]amine Formula: C21H28FN5O2S MolecularWeight: 433.542723

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)CN(C)CCC3=CN(N=C3)C

Isomeric SMILES

CC(C)S(=O)(=O)C1=NC=C(N1CC2=CC=CC=C2F)CN(C)CCC3=CN(N=C3)C

InChI

InChI=1S/C21H28FN5O2S/c1-16(2)30(28,29)21-23-12-19(27(21)14-18-7-5-6-8-20(18)22)15-25(3)10-9-17-11-24-26(4)13-17/h5-8,11-13,16H,9-10,14-15H2,1-4H3