methyl 2-[2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-(2-methyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(2-isobutyrylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N=C1N(C2=CC=CC=C2S1)CC(=O)OC

Isomeric SMILES

CC(C)C(=O)N=C1N(C2=CC=CC=C2S1)CC(=O)OC

InChI

InChI=1S/C14H16N2O3S/c1-9(2)13(18)15-14-16(8-12(17)19-3)10-6-4-5-7-11(10)20-14/h4-7,9H,8H2,1-3H3