1,3-bis(2-chloroethyl)-1-nitroso-urea; 5-iodanyl-1H-pyrimidine-2,4-dione

Systemtic Name: 1,3-bis(2-chloroethyl)-1-nitroso-urea; 5-iodanyl-1H-pyrimidine-2,4-dione Openeye Name: 1,3-bis(2-chloroethyl)-1-nitroso-urea; 5-iodo-1H-pyrimidine-2,4-dione CAS Name: 1,3-bis(2-chloroethyl)-1-nitrosourea; 5-iodo-1H-pyrimidine-2,4-dione IUPAC Name: 1,3-bis(2-chloroethyl)-1-nitrosourea; 5-iodo-1H-pyrimidine-2,4-dione Traditional Name: 1,3-bis(2-chloroethyl)-1-nitroso-urea; 5-iodouracil Formula: C9H12Cl2IN5O4 MolecularWeight: 452.03315

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=O)NC(=O)N1)I.C(CCl)NC(=O)N(CCCl)N=O

Isomeric SMILES

C1=C(C(=O)NC(=O)N1)I.C(CCl)NC(=O)N(CCCl)N=O

InChI

InChI=1S/C5H9Cl2N3O2.C4H3IN2O2/c6-1-3-8-5(11)10(9-12)4-2-7;5-2-1-6-4(9)7-3(2)8/h1-4H2,(H,8,11);1H,(H2,6,7,8,9)