ethyl 2-[2-[2-(4-chlorophenyl)-4-oxidanylidene-chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[2-[2-(4-chlorophenyl)-4-oxidanylidene-chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[2-[2-(4-chlorophenyl)-4-oxo-chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-[[2-(4-chlorophenyl)-4-oxo-1-benzopyran-3-yl]oxy]-1-oxobutyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[2-[2-(4-chlorophenyl)-4-oxochromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[2-[2-(4-chlorophenyl)-4-keto-chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C29H23ClN2O6S MolecularWeight: 563.02072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OCC)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CCC(C(=O)NC1=NC2=C(S1)C=C(C=C2)C(=O)OCC)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C29H23ClN2O6S/c1-3-21(27(34)32-29-31-20-14-11-17(15-23(20)39-29)28(35)36-4-2)37-26-24(33)19-7-5-6-8-22(19)38-25(26)16-9-12-18(30)13-10-16/h5-15,21H,3-4H2,1-2H3,(H,31,32,34)