methyl 2-[2-[[(2-oxidanyl-3-phenoxy-propyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-5-phenyl-1,3-thiazole-4-carboxylate

Systemtic Name: methyl 2-[2-[[(2-oxidanyl-3-phenoxy-propyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-5-phenyl-1,3-thiazole-4-carboxylate Openeye Name: methyl 2-[2-[[(2-hydroxy-3-phenoxy-propyl)amino]methyl]chroman-6-yl]-5-phenyl-thiazole-4-carboxylate CAS Name: 2-[2-[[(2-hydroxy-3-phenoxypropyl)amino]methyl]-3,4-dihydro-2H-1-benzopyran-6-yl]-5-phenyl-4-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[2-[[(2-hydroxy-3-phenoxypropyl)amino]methyl]-3,4-dihydro-2H-chromen-6-yl]-5-phenyl-1,3-thiazole-4-carboxylate Traditional Name: 2-[2-[[(2-hydroxy-3-phenoxy-propyl)amino]methyl]chroman-6-yl]-5-phenyl-thiazole-4-carboxylic acid methyl ester Formula: C30H30N2O5S MolecularWeight: 530.6346

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=N1)C2=CC3=C(C=C2)OC(CC3)CNCC(COC4=CC=CC=C4)O)C5=CC=CC=C5

Isomeric SMILES

COC(=O)C1=C(SC(=N1)C2=CC3=C(C=C2)OC(CC3)CNCC(COC4=CC=CC=C4)O)C5=CC=CC=C5

InChI

InChI=1S/C30H30N2O5S/c1-35-30(34)27-28(20-8-4-2-5-9-20)38-29(32-27)22-13-15-26-21(16-22)12-14-25(37-26)18-31-17-23(33)19-36-24-10-6-3-7-11-24/h2-11,13,15-16,23,25,31,33H,12,14,17-19H2,1H3