5,5-dimethyl-6-(oxidanylcarbamoyl)-4-oxidanylidene-3-(phenylmethyl)-1,3-diazinane-1-sulfinic acid

Systemtic Name: 5,5-dimethyl-6-(oxidanylcarbamoyl)-4-oxidanylidene-3-(phenylmethyl)-1,3-diazinane-1-sulfinic acid Openeye Name: 3-benzyl-6-(hydroxycarbamoyl)-5,5-dimethyl-4-oxo-hexahydropyrimidine-1-sulfinic acid CAS Name: 6-[(hydroxyamino)-oxomethyl]-5,5-dimethyl-4-oxo-3-(phenylmethyl)-1,3-diazinane-1-sulfinic acid IUPAC Name: 3-benzyl-6-(hydroxycarbamoyl)-5,5-dimethyl-4-oxo-1,3-diazinane-1-sulfinic acid Traditional Name: 3-benzyl-6-(hydroxycarbamoyl)-4-keto-5,5-dimethyl-hexahydropyrimidine-1-sulfinic acid Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(N(CN(C1=O)CC2=CC=CC=C2)S(=O)O)C(=O)NO)C

Isomeric SMILES

CC1(C(N(CN(C1=O)CC2=CC=CC=C2)S(=O)O)C(=O)NO)C

InChI

InChI=1S/C14H19N3O5S/c1-14(2)11(12(18)15-20)17(23(21)22)9-16(13(14)19)8-10-6-4-3-5-7-10/h3-7,11,20H,8-9H2,1-2H3,(H,15,18)(H,21,22)