3-[4-(azetidin-1-ylcarbonyl)phenoxy]-5-[(2S)-but-3-yn-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide

Systemtic Name: 3-[4-(azetidin-1-ylcarbonyl)phenoxy]-5-[(2S)-but-3-yn-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide Openeye Name: 3-[4-(azetidine-1-carbonyl)phenoxy]-5-[(1S)-1-methylprop-2-ynoxy]-N-(1-methylpyrazol-3-yl)benzamide CAS Name: 3-[4-[1-azetidinyl(oxo)methyl]phenoxy]-5-[(2S)-but-3-yn-2-yl]oxy-N-(1-methyl-3-pyrazolyl)benzamide IUPAC Name: 3-[4-(azetidine-1-carbonyl)phenoxy]-5-[(2S)-but-3-yn-2-yl]oxy-N-(1-methylpyrazol-3-yl)benzamide Traditional Name: 3-[4-(azetidine-1-carbonyl)phenoxy]-5-[(1S)-1-methylprop-2-ynoxy]-N-(1-methylpyrazol-3-yl)benzamide Formula: C25H24N4O4 MolecularWeight: 444.48246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)C(=O)N3CCC3)C(=O)NC4=NN(C=C4)C

Isomeric SMILES

C[C@@H](C#C)OC1=CC(=CC(=C1)OC2=CC=C(C=C2)C(=O)N3CCC3)C(=O)NC4=NN(C=C4)C

InChI

InChI=1S/C25H24N4O4/c1-4-17(2)32-21-14-19(24(30)26-23-10-13-28(3)27-23)15-22(16-21)33-20-8-6-18(7-9-20)25(31)29-11-5-12-29/h1,6-10,13-17H,5,11-12H2,2-3H3,(H,26,27,30)/t17-/m0/s1