(2S)-2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide

Systemtic Name: (2S)-2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Openeye Name: (2S)-2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(5-methylisoxazol-3-yl)butanamide CAS Name: (2S)-2-[[1-(4-bromophenyl)-2-imidazolyl]thio]-N-(5-methyl-3-isoxazolyl)butanamide IUPAC Name: (2S)-2-[1-(4-bromophenyl)imidazol-2-yl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)butanamide Traditional Name: (2S)-2-[[1-(4-bromophenyl)imidazol-2-yl]thio]-N-(5-methylisoxazol-3-yl)butyramide Formula: C17H17BrN4O2S MolecularWeight: 421.31148

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NOC(=C1)C)SC2=NC=CN2C3=CC=C(C=C3)Br

Isomeric SMILES

CC[C@@H](C(=O)NC1=NOC(=C1)C)SC2=NC=CN2C3=CC=C(C=C3)Br

InChI

InChI=1S/C17H17BrN4O2S/c1-3-14(16(23)20-15-10-11(2)24-21-15)25-17-19-8-9-22(17)13-6-4-12(18)5-7-13/h4-10,14H,3H2,1-2H3,(H,20,21,23)/t14-/m0/s1