ethyl (5R,6S)-4-methylidene-6-[5-(4-morpholin-4-ylsulfonylphenyl)furan-2-yl]-2-oxidanylidene-1,3-diazinane-5-carboxylate

Systemtic Name: ethyl (5R,6S)-4-methylidene-6-[5-(4-morpholin-4-ylsulfonylphenyl)furan-2-yl]-2-oxidanylidene-1,3-diazinane-5-carboxylate Openeye Name: ethyl (5R,6S)-4-methylene-6-[5-(4-morpholinosulfonylphenyl)-2-furyl]-2-oxo-hexahydropyrimidine-5-carboxylate CAS Name: (5R,6S)-4-methylene-6-[5-[4-(4-morpholinylsulfonyl)phenyl]-2-furanyl]-2-oxo-1,3-diazinane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (5R,6S)-4-methylidene-6-[5-(4-morpholin-4-ylsulfonylphenyl)furan-2-yl]-2-oxo-1,3-diazinane-5-carboxylate Traditional Name: (5R,6S)-2-keto-4-methylene-6-[5-(4-morpholinosulfonylphenyl)-2-furyl]hexahydropyrimidine-5-carboxylic acid ethyl ester Formula: C22H25N3O7S MolecularWeight: 475.5148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C(NC(=O)NC1=C)C2=CC=C(O2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

Isomeric SMILES

CCOC(=O)[C@@H]1[C@H](NC(=O)NC1=C)C2=CC=C(O2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25N3O7S/c1-3-31-21(26)19-14(2)23-22(27)24-20(19)18-9-8-17(32-18)15-4-6-16(7-5-15)33(28,29)25-10-12-30-13-11-25/h4-9,19-20H,2-3,10-13H2,1H3,(H2,23,24,27)/t19-,20+/m0/s1