ethyl 2-[6-acetamido-2-[3,5-bis(chloranyl)phenyl]carbonylimino-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-acetamido-2-[3,5-bis(chloranyl)phenyl]carbonylimino-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-acetamido-2-(3,5-dichlorobenzoyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-acetamido-2-[(3,5-dichlorophenyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-acetamido-2-(3,5-dichlorobenzoyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-acetamido-2-(3,5-dichlorobenzoyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C20H17Cl2N3O4S MolecularWeight: 466.33768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)C)SC1=NC(=O)C3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)NC(=O)C)SC1=NC(=O)C3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C20H17Cl2N3O4S/c1-3-29-18(27)10-25-16-5-4-15(23-11(2)26)9-17(16)30-20(25)24-19(28)12-6-13(21)8-14(22)7-12/h4-9H,3,10H2,1-2H3,(H,23,26)