[2-(4-ethylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxidanylidenechromene-3-carboxylate

Systemtic Name: [2-(4-ethylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxidanylidenechromene-3-carboxylate Openeye Name: [2-(4-ethylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxochromene-3-carboxylate CAS Name: 2-oxo-1-benzopyran-3-carboxylic acid [2-(4-ethyl-1-piperazinyl)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(4-ethylpiperazin-1-yl)-1,3-benzothiazol-6-yl] 2-oxochromene-3-carboxylate Traditional Name: 2-ketochromene-3-carboxylic acid [2-(4-ethylpiperazino)-1,3-benzothiazol-6-yl] ester Formula: C23H21N3O4S MolecularWeight: 435.49554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=CC5=CC=CC=C5OC4=O

Isomeric SMILES

CCN1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)OC(=O)C4=CC5=CC=CC=C5OC4=O

InChI

InChI=1S/C23H21N3O4S/c1-2-25-9-11-26(12-10-25)23-24-18-8-7-16(14-20(18)31-23)29-21(27)17-13-15-5-3-4-6-19(15)30-22(17)28/h3-8,13-14H,2,9-12H2,1H3