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

Systemtic Name: ethyl 2-[2-[2-(4-methylphenyl)-4-oxidanylidene-chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[2-[4-oxo-2-(p-tolyl)chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[2-[[2-(4-methylphenyl)-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-methylphenyl)-4-oxochromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[2-[4-keto-2-(p-tolyl)chromen-3-yl]oxybutanoylamino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C30H26N2O6S MolecularWeight: 542.60224

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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)C

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)C

InChI

InChI=1S/C30H26N2O6S/c1-4-22(28(34)32-30-31-21-15-14-19(16-24(21)39-30)29(35)36-5-2)37-27-25(33)20-8-6-7-9-23(20)38-26(27)18-12-10-17(3)11-13-18/h6-16,22H,4-5H2,1-3H3,(H,31,32,34)