methyl 2-[2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[(6-chloranyl-1H-benzimidazol-2-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(6-chloro-1H-benzimidazol-2-yl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(6-chloro-1H-benzimidazol-2-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(6-chloro-1H-benzimidazol-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C12H12ClN3O3S MolecularWeight: 313.75998

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NC2=C(N1)C=C(C=C2)Cl

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NC2=C(N1)C=C(C=C2)Cl

InChI

InChI=1S/C12H12ClN3O3S/c1-19-11(18)5-14-10(17)6-20-12-15-8-3-2-7(13)4-9(8)16-12/h2-4H,5-6H2,1H3,(H,14,17)(H,15,16)