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

Systemtic Name: N-[(2S)-1-[[4-(dimethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[(1S)-1-[[4-(dimethylaminomethyl)phenyl]methylcarbamoyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[(2S)-1-[[4-(dimethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[(2S)-1-[[4-(dimethylaminomethyl)phenyl]methylamino]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[(1S)-1-[[4-(dimethylaminomethyl)benzyl]carbamoyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C22H28FN3O2 MolecularWeight: 385.475023

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(C=C1)CN(C)C)NC(=O)C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(C=C1)CN(C)C)NC(=O)C2=CC=C(C=C2)F

InChI

InChI=1S/C22H28FN3O2/c1-15(2)20(25-21(27)18-9-11-19(23)12-10-18)22(28)24-13-16-5-7-17(8-6-16)14-26(3)4/h5-12,15,20H,13-14H2,1-4H3,(H,24,28)(H,25,27)/t20-/m0/s1