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

Systemtic Name: N-[5-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-2-bromanyl-benzamide Openeye Name: N-[5-(2-amino-2-oxo-ethyl)sulfanyl-4-methyl-thiazol-2-yl]-2-bromo-benzamide CAS Name: N-[5-[(2-amino-2-oxoethyl)thio]-4-methyl-2-thiazolyl]-2-bromobenzamide IUPAC Name: N-[5-(2-amino-2-oxoethyl)sulfanyl-4-methyl-1,3-thiazol-2-yl]-2-bromobenzamide Traditional Name: N-[5-[(2-amino-2-keto-ethyl)thio]-4-methyl-thiazol-2-yl]-2-bromo-benzamide Formula: C13H12BrN3O2S2 MolecularWeight: 386.28728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=CC=CC=C2Br)SCC(=O)N

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=CC=CC=C2Br)SCC(=O)N

InChI

InChI=1S/C13H12BrN3O2S2/c1-7-12(20-6-10(15)18)21-13(16-7)17-11(19)8-4-2-3-5-9(8)14/h2-5H,6H2,1H3,(H2,15,18)(H,16,17,19)