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

Systemtic Name: 3-[2-[(5-chloranyl-1,3-benzothiazol-2-yl)sulfanyl]ethanoylamino]benzoate Openeye Name: 3-[[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoate CAS Name: 3-[[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]-1-oxoethyl]amino]benzoate IUPAC Name: 3-[[2-[(5-chloro-1,3-benzothiazol-2-yl)sulfanyl]acetyl]amino]benzoate Traditional Name: 3-[[2-[(5-chloro-1,3-benzothiazol-2-yl)thio]acetyl]amino]benzoate Formula: C16H10ClN2O3S2- MolecularWeight: 377.8452

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)C(=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CSC2=NC3=C(S2)C=CC(=C3)Cl)C(=O)[O-]

InChI

InChI=1S/C16H11ClN2O3S2/c17-10-4-5-13-12(7-10)19-16(24-13)23-8-14(20)18-11-3-1-2-9(6-11)15(21)22/h1-7H,8H2,(H,18,20)(H,21,22)/p-1