(2S)-2-(3-bromophenyl)-4-cyclopropyl-N-[4-(2-methylpyridin-4-yl)phenyl]butanamide

Systemtic Name: (2S)-2-(3-bromophenyl)-4-cyclopropyl-N-[4-(2-methylpyridin-4-yl)phenyl]butanamide Openeye Name: (2S)-2-(3-bromophenyl)-4-cyclopropyl-N-[4-(2-methyl-4-pyridyl)phenyl]butanamide CAS Name: (2S)-2-(3-bromophenyl)-4-cyclopropyl-N-[4-(2-methyl-4-pyridinyl)phenyl]butanamide IUPAC Name: (2S)-2-(3-bromophenyl)-4-cyclopropyl-N-[4-(2-methylpyridin-4-yl)phenyl]butanamide Traditional Name: (2S)-2-(3-bromophenyl)-4-cyclopropyl-N-[4-(2-methyl-4-pyridyl)phenyl]butyramide Formula: C25H25BrN2O MolecularWeight: 449.3828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=CC(=C1)C2=CC=C(C=C2)NC(=O)C(CCC3CC3)C4=CC(=CC=C4)Br

Isomeric SMILES

CC1=NC=CC(=C1)C2=CC=C(C=C2)NC(=O)[C@@H](CCC3CC3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C25H25BrN2O/c1-17-15-20(13-14-27-17)19-8-10-23(11-9-19)28-25(29)24(12-7-18-5-6-18)21-3-2-4-22(26)16-21/h2-4,8-11,13-16,18,24H,5-7,12H2,1H3,(H,28,29)/t24-/m0/s1