[2-(diethylamino)-1,3-benzothiazol-6-yl] 3-oxidanylidenebenzo[f]chromene-2-carboxylate

Systemtic Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 3-oxidanylidenebenzo[f]chromene-2-carboxylate Openeye Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 3-oxobenzo[f]chromene-2-carboxylate CAS Name: 3-oxo-2-benzo[f][1]benzopyrancarboxylic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(diethylamino)-1,3-benzothiazol-6-yl] 3-oxobenzo[f]chromene-2-carboxylate Traditional Name: 3-ketobenzo[f]chromene-2-carboxylic acid [2-(diethylamino)-1,3-benzothiazol-6-yl] ester Formula: C25H20N2O4S MolecularWeight: 444.5023

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=NC2=C(S1)C=C(C=C2)OC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O

Isomeric SMILES

CCN(CC)C1=NC2=C(S1)C=C(C=C2)OC(=O)C3=CC4=C(C=CC5=CC=CC=C54)OC3=O

InChI

InChI=1S/C25H20N2O4S/c1-3-27(4-2)25-26-20-11-10-16(13-22(20)32-25)30-23(28)19-14-18-17-8-6-5-7-15(17)9-12-21(18)31-24(19)29/h5-14H,3-4H2,1-2H3