N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-bromanyl-2-fluoranyl-benzamide

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-bromanyl-2-fluoranyl-benzamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-4-bromo-2-fluoro-benzamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-4-bromo-2-fluorobenzamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-4-bromo-2-fluorobenzamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-4-bromo-2-fluoro-benzamide Formula: C13H11BrFN3O2S2 MolecularWeight: 404.277743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)Br)F)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=C(C=C(C=C2)Br)F)SCC(=O)N

InChI

InChI=1S/C13H11BrFN3O2S2/c1-6-12(21-5-10(16)19)22-13(17-6)18-11(20)8-3-2-7(14)4-9(8)15/h2-4H,5H2,1H3,(H2,16,19)(H,17,18,20)