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

Systemtic Name: 2-(1-azanyl-3-methylsulfanyl-propyl)-N-[2-(4-bromophenyl)-2-oxidanylidene-ethyl]-1,3-oxazole-4-carboxamide Openeye Name: 2-(1-amino-3-methylsulfanyl-propyl)-N-[2-(4-bromophenyl)-2-oxo-ethyl]oxazole-4-carboxamide CAS Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-(4-bromophenyl)-2-oxoethyl]-4-oxazolecarboxamide IUPAC Name: 2-(1-amino-3-methylsulfanylpropyl)-N-[2-(4-bromophenyl)-2-oxoethyl]-1,3-oxazole-4-carboxamide Traditional Name: 2-[1-amino-3-(methylthio)propyl]-N-[2-(4-bromophenyl)-2-keto-ethyl]oxazole-4-carboxamide Formula: C16H18BrN3O3S MolecularWeight: 412.30142

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H18BrN3O3S/c1-24-7-6-12(18)16-20-13(9-23-16)15(22)19-8-14(21)10-2-4-11(17)5-3-10/h2-5,9,12H,6-8,18H2,1H3,(H,19,22)