N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-[2-(3-methoxyazetidin-1-yl)ethoxy]phenyl]-3-methyl-butanamide

Systemtic Name: N-[3-(4-bromanyl-2-methyl-pyrazol-3-yl)-4-[2-(3-methoxyazetidin-1-yl)ethoxy]phenyl]-3-methyl-butanamide Openeye Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-[2-(3-methoxyazetidin-1-yl)ethoxy]phenyl]-3-methyl-butanamide CAS Name: N-[3-(4-bromo-2-methyl-3-pyrazolyl)-4-[2-(3-methoxy-1-azetidinyl)ethoxy]phenyl]-3-methylbutanamide IUPAC Name: N-[3-(4-bromo-2-methylpyrazol-3-yl)-4-[2-(3-methoxyazetidin-1-yl)ethoxy]phenyl]-3-methylbutanamide Traditional Name: N-[3-(4-bromo-2-methyl-pyrazol-3-yl)-4-[2-(3-methoxyazetidin-1-yl)ethoxy]phenyl]-3-methyl-butyramide Formula: C21H29BrN4O3 MolecularWeight: 465.38396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)OCCN2CC(C2)OC)C3=C(C=NN3C)Br

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)OCCN2CC(C2)OC)C3=C(C=NN3C)Br

InChI

InChI=1S/C21H29BrN4O3/c1-14(2)9-20(27)24-15-5-6-19(29-8-7-26-12-16(13-26)28-4)17(10-15)21-18(22)11-23-25(21)3/h5-6,10-11,14,16H,7-9,12-13H2,1-4H3,(H,24,27)