ethyl 2-[6-bromanyl-2-[(3-methyl-1,2-oxazol-5-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-bromanyl-2-[(3-methyl-1,2-oxazol-5-yl)carbonylimino]-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-bromo-2-(3-methylisoxazole-5-carbonyl)imino-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-bromo-2-[(3-methyl-5-isoxazolyl)-oxomethyl]imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-bromo-2-(3-methyl-1,2-oxazole-5-carbonyl)imino-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[6-bromo-2-(3-methylisoxazole-5-carbonyl)imino-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C16H14BrN3O4S MolecularWeight: 424.26906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3=CC(=NO3)C

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)Br)SC1=NC(=O)C3=CC(=NO3)C

InChI

InChI=1S/C16H14BrN3O4S/c1-3-23-14(21)8-20-11-5-4-10(17)7-13(11)25-16(20)18-15(22)12-6-9(2)19-24-12/h4-7H,3,8H2,1-2H3