methyl 2-[6-butyl-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: methyl 2-[6-butyl-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]ethanoate Openeye Name: methyl 2-[6-butyl-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[6-butyl-2-(2-methyl-1-oxopropyl)imino-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-[6-butyl-2-(2-methylpropanoylimino)-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-(6-butyl-2-isobutyrylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)C(C)C)S2)CC(=O)OC

Isomeric SMILES

CCCCC1=CC2=C(C=C1)N(C(=NC(=O)C(C)C)S2)CC(=O)OC

InChI

InChI=1S/C18H24N2O3S/c1-5-6-7-13-8-9-14-15(10-13)24-18(19-17(22)12(2)3)20(14)11-16(21)23-4/h8-10,12H,5-7,11H2,1-4H3