methyl 1,3-dimethyl-5-(3-phenoxyphenyl)sulfonyl-1,3-diazinane-5-carboxylate

Systemtic Name: methyl 1,3-dimethyl-5-(3-phenoxyphenyl)sulfonyl-1,3-diazinane-5-carboxylate Openeye Name: methyl 1,3-dimethyl-5-(3-phenoxyphenyl)sulfonyl-hexahydropyrimidine-5-carboxylate CAS Name: 1,3-dimethyl-5-(3-phenoxyphenyl)sulfonyl-1,3-diazinane-5-carboxylic acid methyl ester IUPAC Name: methyl 1,3-dimethyl-5-(3-phenoxyphenyl)sulfonyl-1,3-diazinane-5-carboxylate Traditional Name: 1,3-dimethyl-5-(3-phenoxyphenyl)sulfonyl-hexahydropyrimidine-5-carboxylic acid methyl ester Formula: C20H24N2O5S MolecularWeight: 404.47996

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(CN(C1)C)(C(=O)OC)S(=O)(=O)C2=CC=CC(=C2)OC3=CC=CC=C3

Isomeric SMILES

CN1CC(CN(C1)C)(C(=O)OC)S(=O)(=O)C2=CC=CC(=C2)OC3=CC=CC=C3

InChI

InChI=1S/C20H24N2O5S/c1-21-13-20(19(23)26-3,14-22(2)15-21)28(24,25)18-11-7-10-17(12-18)27-16-8-5-4-6-9-16/h4-12H,13-15H2,1-3H3