2-dodecyl-6-(2-ethylphenyl)-4-methyl-4a,7,8,9a-tetrahydropurino[7,8-a]imidazole-1,3-dione

Systemtic Name: 2-dodecyl-6-(2-ethylphenyl)-4-methyl-4a,7,8,9a-tetrahydropurino[7,8-a]imidazole-1,3-dione Openeye Name: 2-dodecyl-6-(2-ethylphenyl)-4-methyl-4a,7,8,9a-tetrahydropurino[7,8-a]imidazole-1,3-dione CAS Name: 2-dodecyl-6-(2-ethylphenyl)-4-methyl-4a,7,8,9a-tetrahydropurino[7,8-a]imidazole-1,3-dione IUPAC Name: 2-dodecyl-6-(2-ethylphenyl)-4-methyl-4a,7,8,9a-tetrahydropurino[7,8-a]imidazole-1,3-dione Traditional Name: 6-(2-ethylphenyl)-2-lauryl-4-methyl-4a,7,8,9a-tetrahydropurin[7,8-a]imidazole-1,3-quinone Formula: C28H43N5O2 MolecularWeight: 481.67332

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCN1C(=O)C2C(N=C3N2CCN3C4=CC=CC=C4CC)N(C1=O)C

Isomeric SMILES

CCCCCCCCCCCCN1C(=O)C2C(N=C3N2CCN3C4=CC=CC=C4CC)N(C1=O)C

InChI

InChI=1S/C28H43N5O2/c1-4-6-7-8-9-10-11-12-13-16-19-33-26(34)24-25(30(3)28(33)35)29-27-31(20-21-32(24)27)23-18-15-14-17-22(23)5-2/h14-15,17-18,24-25H,4-13,16,19-21H2,1-3H3