3-[4-[3-azanyl-4-(3-fluoranylpyrrolidin-1-yl)-4-oxidanylidene-butan-2-yl]phenyl]-N-tert-butyl-benzamide

Systemtic Name: 3-[4-[3-azanyl-4-(3-fluoranylpyrrolidin-1-yl)-4-oxidanylidene-butan-2-yl]phenyl]-N-tert-butyl-benzamide Openeye Name: 3-[4-[2-amino-3-(3-fluoropyrrolidin-1-yl)-1-methyl-3-oxo-propyl]phenyl]-N-tert-butyl-benzamide CAS Name: 3-[4-[3-amino-4-(3-fluoro-1-pyrrolidinyl)-4-oxobutan-2-yl]phenyl]-N-tert-butylbenzamide IUPAC Name: 3-[4-[3-amino-4-(3-fluoropyrrolidin-1-yl)-4-oxobutan-2-yl]phenyl]-N-tert-butylbenzamide Traditional Name: 3-[4-[2-amino-3-(3-fluoropyrrolidino)-3-keto-1-methyl-propyl]phenyl]-N-tert-butyl-benzamide Formula: C25H32FN3O2 MolecularWeight: 425.538883

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)NC(C)(C)C)C(C(=O)N3CCC(C3)F)N

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC(=CC=C2)C(=O)NC(C)(C)C)C(C(=O)N3CCC(C3)F)N

InChI

InChI=1S/C25H32FN3O2/c1-16(22(27)24(31)29-13-12-21(26)15-29)17-8-10-18(11-9-17)19-6-5-7-20(14-19)23(30)28-25(2,3)4/h5-11,14,16,21-22H,12-13,15,27H2,1-4H3,(H,28,30)