ethyl 2-(4,6-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: ethyl 2-(4,6-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)ethanoate Openeye Name: ethyl 2-(4,6-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[4,6-dimethyl-2-(1-oxopentylimino)-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-(4,6-dimethyl-2-pentanoylimino-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(4,6-dimethyl-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid ethyl ester Formula: C18H24N2O3S MolecularWeight: 348.45976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(C=C(C=C2S1)C)C)CC(=O)OCC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(C=C(C=C2S1)C)C)CC(=O)OCC

InChI

InChI=1S/C18H24N2O3S/c1-5-7-8-15(21)19-18-20(11-16(22)23-6-2)17-13(4)9-12(3)10-14(17)24-18/h9-10H,5-8,11H2,1-4H3