2-(1-azanyl-3-methylsulfanyl-propyl)-N-[(3-bromophenyl)methyl]-1,3-oxazole-4-carboxamide

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[(3-bromophenyl)methyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[(3-bromophenyl)methyl]oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[(3-bromophenyl)methyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[(3-bromophenyl)methyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-(3-bromobenzyl)oxazole-4-carboxamide Formula: C15H18BrN3O2S MolecularWeight: 384.29132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC(=CO1)C(=O)NCC2=CC(=CC=C2)Br)N

Isomeric SMILES

CSCCC(C1=NC(=CO1)C(=O)NCC2=CC(=CC=C2)Br)N

InChI

InChI=1S/C15H18BrN3O2S/c1-22-6-5-12(17)15-19-13(9-21-15)14(20)18-8-10-3-2-4-11(16)7-10/h2-4,7,9,12H,5-6,8,17H2,1H3,(H,18,20)