methyl 2-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoylamino]ethanoate

Systemtic Name: methyl 2-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoylamino]ethanoate Openeye Name: methyl 2-[[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]acetate CAS Name: 2-[[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]acetate Traditional Name: 2-[[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]acetyl]amino]acetic acid methyl ester Formula: C12H11ClN2O3S2 MolecularWeight: 330.81034

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CNC(=O)CSC1=NC2=C(S1)C=CC(=C2)Cl

Isomeric SMILES

COC(=O)CNC(=O)CSC1=NC2=C(S1)C=CC(=C2)Cl

InChI

InChI=1S/C12H11ClN2O3S2/c1-18-11(17)5-14-10(16)6-19-12-15-8-4-7(13)2-3-9(8)20-12/h2-4H,5-6H2,1H3,(H,14,16)