N-[(2S)-1-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[(2S)-1-[4-[(3-fluoranyl-4-methoxy-phenyl)methyl]piperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-[4-[(3-fluoro-4-methoxy-phenyl)methyl]piperazine-1-carbonyl]-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-[4-[(3-fluoro-4-methoxyphenyl)methyl]-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-[4-[(3-fluoro-4-methoxyphenyl)methyl]piperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-[4-(3-fluoro-4-methoxy-benzyl)piperazine-1-carbonyl]-2-methyl-propyl]-2-methyl-benzamide Formula: C25H32FN3O3 MolecularWeight: 441.538283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)N2CCN(CC2)CC3=CC(=C(C=C3)OC)F

InChI

InChI=1S/C25H32FN3O3/c1-17(2)23(27-24(30)20-8-6-5-7-18(20)3)25(31)29-13-11-28(12-14-29)16-19-9-10-22(32-4)21(26)15-19/h5-10,15,17,23H,11-14,16H2,1-4H3,(H,27,30)/t23-/m0/s1