methyl 2-chloranyl-5-[2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]benzoate

Systemtic Name: methyl 2-chloranyl-5-[2-[(5-chloranyl-1,3-benzoxazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: methyl 2-chloro-5-[[2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 2-chloro-5-[[2-[(5-chloro-1,3-benzoxazol-2-yl)thio]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-5-[[2-[(5-chloro-1,3-benzoxazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 2-chloro-5-[[2-[(5-chloro-1,3-benzoxazol-2-yl)thio]acetyl]amino]benzoic acid methyl ester Formula: C17H12Cl2N2O4S MolecularWeight: 411.25918

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)Cl)Cl

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)NC(=O)CSC2=NC3=C(O2)C=CC(=C3)Cl)Cl

InChI

InChI=1S/C17H12Cl2N2O4S/c1-24-16(23)11-7-10(3-4-12(11)19)20-15(22)8-26-17-21-13-6-9(18)2-5-14(13)25-17/h2-7H,8H2,1H3,(H,20,22)