5-[[(4-butan-2-ylphenyl)amino]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione

Systemtic Name: 5-[[(4-butan-2-ylphenyl)amino]methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Openeye Name: 1-(2-furylmethyl)-5-[(4-sec-butylanilino)methylene]hexahydropyrimidine-2,4,6-trione CAS Name: 5-[(4-butan-2-ylanilino)methylidene]-1-(2-furanylmethyl)-1,3-diazinane-2,4,6-trione IUPAC Name: 5-[(4-butan-2-ylanilino)methylidene]-1-(furan-2-ylmethyl)-1,3-diazinane-2,4,6-trione Traditional Name: 1-(2-furfuryl)-5-[(4-sec-butylanilino)methylene]barbituric acid Formula: C20H21N3O4 MolecularWeight: 367.39844

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)NC=C2C(=O)NC(=O)N(C2=O)CC3=CC=CO3

InChI

InChI=1S/C20H21N3O4/c1-3-13(2)14-6-8-15(9-7-14)21-11-17-18(24)22-20(26)23(19(17)25)12-16-5-4-10-27-16/h4-11,13,21H,3,12H2,1-2H3,(H,22,24,26)