2-ethylimino-6-(2-methylpropyl)-5-oxidanylidene-3-(phenylmethyl)-1,3-diazinane-1-carboxylic acid

Systemtic Name: 2-ethylimino-6-(2-methylpropyl)-5-oxidanylidene-3-(phenylmethyl)-1,3-diazinane-1-carboxylic acid Openeye Name: 3-benzyl-2-ethylimino-6-isobutyl-5-oxo-hexahydropyrimidine-1-carboxylic acid CAS Name: 2-ethylimino-6-(2-methylpropyl)-5-oxo-3-(phenylmethyl)-1,3-diazinane-1-carboxylic acid IUPAC Name: 3-benzyl-2-ethylimino-6-(2-methylpropyl)-5-oxo-1,3-diazinane-1-carboxylic acid Traditional Name: 3-benzyl-2-ethylimino-6-isobutyl-5-keto-hexahydropyrimidine-1-carboxylic acid Formula: C18H25N3O3 MolecularWeight: 331.4094

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Descriptors Computed from Structure

Canonical SMILES:

CCN=C1N(CC(=O)C(N1C(=O)O)CC(C)C)CC2=CC=CC=C2

Isomeric SMILES

CCN=C1N(CC(=O)C(N1C(=O)O)CC(C)C)CC2=CC=CC=C2

InChI

InChI=1S/C18H25N3O3/c1-4-19-17-20(11-14-8-6-5-7-9-14)12-16(22)15(10-13(2)3)21(17)18(23)24/h5-9,13,15H,4,10-12H2,1-3H3,(H,23,24)