1,3-dimethyl-6-[3-[[4-nitro-2-(phenylcarbonyl)phenyl]amino]propylamino]pyrimidine-2,4-dione

Systemtic Name: 1,3-dimethyl-6-[3-[[4-nitro-2-(phenylcarbonyl)phenyl]amino]propylamino]pyrimidine-2,4-dione Openeye Name: 6-[3-(2-benzoyl-4-nitro-anilino)propylamino]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 6-[3-(2-benzoyl-4-nitroanilino)propylamino]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 6-[3-(2-benzoyl-4-nitroanilino)propylamino]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 6-[3-(2-benzoyl-4-nitro-anilino)propylamino]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C22H23N5O5 MolecularWeight: 437.44852

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC(=O)N(C1=O)C)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

Isomeric SMILES

CN1C(=CC(=O)N(C1=O)C)NCCCNC2=C(C=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H23N5O5/c1-25-19(14-20(28)26(2)22(25)30)24-12-6-11-23-18-10-9-16(27(31)32)13-17(18)21(29)15-7-4-3-5-8-15/h3-5,7-10,13-14,23-24H,6,11-12H2,1-2H3