Summary

Molecular formula: C12H12N4O3
SMILES: O=C1NC(=O)C(=O)/C(=N/c2cc(C)c(cc2N)C)/N1
InChI: InChI=1S/C12H12N4O3/c1-5-3-7(13)8(4-6(5)2)14-10-9(17)11(18)16-12(19)15-10/h3-4H,13H2,1-2H3,(H2,14,15,16,18,19)
InChIKey: YTTLBEKULJETJA-UHFFFAOYSA-N

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Molecular scaffolds

Scaffold Graph/Node/Bond level:
O=C1NC(=O)C(=O)C(=Nc2ccccc2)N1

Scaffold Graph/Node level:
OC1NC(O)C(O)C(NC2CCCCC2)N1

Scaffold Graph level:
CC1CC(C)C(C)C(CC2CCCCC2)C1

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Chemical classification

Kingdom: Organic compounds
Super class: Benzenoids
Class: Benzene and substituted derivatives
Sub class: Xylenes

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Synonymous chemical names:
(e)-6-((2-amino-4,5-dimethylphenyl)imino)dihydropyrimidine-2,4,5(3h)-trione

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External chemical identifiers:
CID_139591352; NPATLAS_NPA024190

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Chemical structure download