diethyl (2S,5R)-4,5-diphenyl-2-thiophen-2-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate

Systemtic Name: diethyl (2S,5R)-4,5-diphenyl-2-thiophen-2-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate Openeye Name: diethyl (2S,5R)-4,5-diphenyl-2-(2-thienyl)-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate CAS Name: (2S,5R)-4,5-diphenyl-2-thiophen-2-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylic acid diethyl ester IUPAC Name: diethyl (2S,5R)-4,5-diphenyl-2-thiophen-2-yl-2,5-dihydro-1,3-oxazine-6,6-dicarboxylate Traditional Name: (2S,5R)-4,5-diphenyl-2-(2-thienyl)-2,5-dihydro-1,3-oxazine-6,6-dicarboxylic acid diethyl ester Formula: C26H25NO5S MolecularWeight: 463.5454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(C(=NC(O1)C2=CC=CS2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1([C@@H](C(=N[C@@H](O1)C2=CC=CS2)C3=CC=CC=C3)C4=CC=CC=C4)C(=O)OCC

InChI

InChI=1S/C26H25NO5S/c1-3-30-24(28)26(25(29)31-4-2)21(18-12-7-5-8-13-18)22(19-14-9-6-10-15-19)27-23(32-26)20-16-11-17-33-20/h5-17,21,23H,3-4H2,1-2H3/t21-,23+/m1/s1