5-bromanyl-N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(1,3-thiazol-4-ylmethylamino)butan-2-yl]furan-2-carboxamide

Systemtic Name: 5-bromanyl-N-[(2S)-4-methylsulfanyl-1-oxidanylidene-1-(1,3-thiazol-4-ylmethylamino)butan-2-yl]furan-2-carboxamide Openeye Name: 5-bromo-N-[(1S)-3-methylsulfanyl-1-(thiazol-4-ylmethylcarbamoyl)propyl]furan-2-carboxamide CAS Name: 5-bromo-N-[(2S)-4-(methylthio)-1-oxo-1-(4-thiazolylmethylamino)butan-2-yl]-2-furancarboxamide IUPAC Name: 5-bromo-N-[(2S)-4-methylsulfanyl-1-oxo-1-(1,3-thiazol-4-ylmethylamino)butan-2-yl]furan-2-carboxamide Traditional Name: 5-bromo-N-[(1S)-3-(methylthio)-1-(thiazol-4-ylmethylcarbamoyl)propyl]-2-furamide Formula: C14H16BrN3O3S2 MolecularWeight: 418.32914

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC1=CSC=N1)NC(=O)C2=CC=C(O2)Br

Isomeric SMILES

CSCC[C@@H](C(=O)NCC1=CSC=N1)NC(=O)C2=CC=C(O2)Br

InChI

InChI=1S/C14H16BrN3O3S2/c1-22-5-4-10(13(19)16-6-9-7-23-8-17-9)18-14(20)11-2-3-12(15)21-11/h2-3,7-8,10H,4-6H2,1H3,(H,16,19)(H,18,20)/t10-/m0/s1