(phenylmethyl) 4-methyl-2-[2-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxybutanoylamino]-1,3-thiazole-5-carboxylate

Systemtic Name: (phenylmethyl) 4-methyl-2-[2-(4-oxidanylidene-2-phenyl-chromen-3-yl)oxybutanoylamino]-1,3-thiazole-5-carboxylate Openeye Name: benzyl 4-methyl-2-[2-(4-oxo-2-phenyl-chromen-3-yl)oxybutanoylamino]thiazole-5-carboxylate CAS Name: 4-methyl-2-[[1-oxo-2-[(4-oxo-2-phenyl-1-benzopyran-3-yl)oxy]butyl]amino]-5-thiazolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 4-methyl-2-[2-(4-oxo-2-phenylchromen-3-yl)oxybutanoylamino]-1,3-thiazole-5-carboxylate Traditional Name: 2-[2-(4-keto-2-phenyl-chromen-3-yl)oxybutanoylamino]-4-methyl-thiazole-5-carboxylic acid benzyl ester Formula: C31H26N2O6S MolecularWeight: 554.61294

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC2=CC=CC=C2)C)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NC1=NC(=C(S1)C(=O)OCC2=CC=CC=C2)C)OC3=C(OC4=CC=CC=C4C3=O)C5=CC=CC=C5

InChI

InChI=1S/C31H26N2O6S/c1-3-23(29(35)33-31-32-19(2)28(40-31)30(36)37-18-20-12-6-4-7-13-20)38-27-25(34)22-16-10-11-17-24(22)39-26(27)21-14-8-5-9-15-21/h4-17,23H,3,18H2,1-2H3,(H,32,33,35)