5-[(4-methylpentylamino)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[(4-methylpentylamino)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-benzyl-5-[(isohexylamino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-methylpentylamino)methylidene]-1-(phenylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 1-benzyl-5-[(4-methylpentylamino)methylidene]-1,3-diazinane-2,4,6-trione Traditional Name: 1-benzyl-5-[(isohexylamino)methylene]barbituric acid Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCNC=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2

Isomeric SMILES

CC(C)CCCNC=C1C(=O)NC(=O)N(C1=O)CC2=CC=CC=C2

InChI

InChI=1S/C18H23N3O3/c1-13(2)7-6-10-19-11-15-16(22)20-18(24)21(17(15)23)12-14-8-4-3-5-9-14/h3-5,8-9,11,13,19H,6-7,10,12H2,1-2H3,(H,20,22,24)