(2S)-2-acetamido-N-[[5-(4-bromophenyl)furan-2-yl]methyl]-3-methyl-butanamide

Systemtic Name: (2S)-2-acetamido-N-[[5-(4-bromophenyl)furan-2-yl]methyl]-3-methyl-butanamide Openeye Name: (2S)-2-acetamido-N-[[5-(4-bromophenyl)-2-furyl]methyl]-3-methyl-butanamide CAS Name: (2S)-2-acetamido-N-[[5-(4-bromophenyl)-2-furanyl]methyl]-3-methylbutanamide IUPAC Name: (2S)-2-acetamido-N-[[5-(4-bromophenyl)furan-2-yl]methyl]-3-methylbutanamide Traditional Name: (2S)-2-acetamido-N-[[5-(4-bromophenyl)-2-furyl]methyl]-3-methyl-butyramide Formula: C18H21BrN2O3 MolecularWeight: 393.27494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1=CC=C(O1)C2=CC=C(C=C2)Br)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC1=CC=C(O1)C2=CC=C(C=C2)Br)NC(=O)C

InChI

InChI=1S/C18H21BrN2O3/c1-11(2)17(21-12(3)22)18(23)20-10-15-8-9-16(24-15)13-4-6-14(19)7-5-13/h4-9,11,17H,10H2,1-3H3,(H,20,23)(H,21,22)/t17-/m0/s1