5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1-butyl-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1-butyl-1,3-diazinane-2,4,6-trione Openeye Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1-butyl-hexahydropyrimidine-2,4,6-trione CAS Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1-butyl-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1-butyl-1,3-diazinane-2,4,6-trione Traditional Name: 5-[1-(1,3-benzodioxol-5-ylamino)propylidene]-1-butyl-barbituric acid Formula: C18H21N3O5 MolecularWeight: 359.37644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C(=C(CC)NC2=CC3=C(C=C2)OCO3)C(=O)NC1=O

Isomeric SMILES

CCCCN1C(=O)C(=C(CC)NC2=CC3=C(C=C2)OCO3)C(=O)NC1=O

InChI

InChI=1S/C18H21N3O5/c1-3-5-8-21-17(23)15(16(22)20-18(21)24)12(4-2)19-11-6-7-13-14(9-11)26-10-25-13/h6-7,9,19H,3-5,8,10H2,1-2H3,(H,20,22,24)