ethyl 3-(1,3-benzothiazol-2-ylamino)-4-oxidanylidene-pentanoate

Systemtic Name: ethyl 3-(1,3-benzothiazol-2-ylamino)-4-oxidanylidene-pentanoate Openeye Name: ethyl 3-(1,3-benzothiazol-2-ylamino)-4-oxo-pentanoate CAS Name: 3-(1,3-benzothiazol-2-ylamino)-4-oxopentanoic acid ethyl ester IUPAC Name: ethyl 3-(1,3-benzothiazol-2-ylamino)-4-oxopentanoate Traditional Name: 3-(1,3-benzothiazol-2-ylamino)-4-keto-valeric acid ethyl ester Formula: C14H16N2O3S MolecularWeight: 292.35344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C(=O)C)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCOC(=O)CC(C(=O)C)NC1=NC2=CC=CC=C2S1

InChI

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