methyl 3-[6-bromanyl-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate

Systemtic Name: methyl 3-[6-bromanyl-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate Openeye Name: methyl 3-[6-bromo-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate CAS Name: 3-[6-bromo-2-(2-methyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 3-[6-bromo-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]propanoate Traditional Name: 3-(6-bromo-2-isobutyrylimino-1,3-benzothiazol-3-yl)propionic acid methyl ester Formula: C15H17BrN2O3S MolecularWeight: 385.27608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)Br)CCC(=O)OC

Isomeric SMILES

CC(C)C(=O)N=C1N(C2=C(S1)C=C(C=C2)Br)CCC(=O)OC

InChI

InChI=1S/C15H17BrN2O3S/c1-9(2)14(20)17-15-18(7-6-13(19)21-3)11-5-4-10(16)8-12(11)22-15/h4-5,8-9H,6-7H2,1-3H3