2-azanyl-8-[(E)-bis(2-chloroethyl)aminodiazenyl]-3,5-dihydropurin-6-one

Systemtic Name: 2-azanyl-8-[(E)-bis(2-chloroethyl)aminodiazenyl]-3,5-dihydropurin-6-one Openeye Name: 2-amino-8-[(E)-bis(2-chloroethyl)aminoazo]-3,5-dihydropurin-6-one CAS Name: 2-amino-8-[(E)-bis(2-chloroethyl)aminoazo]-3,5-dihydropurin-6-one IUPAC Name: 2-amino-8-[(E)-bis(2-chloroethyl)aminodiazenyl]-3,5-dihydropurin-6-one Traditional Name: 2-amino-8-[(E)-bis(2-chloroethyl)aminoazo]-3,5-dihydropurin-6-one Formula: C9H12Cl2N8O MolecularWeight: 319.15058

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Descriptors Computed from Structure

Canonical SMILES:

C(CCl)N(CCCl)N=NC1=NC2C(=N1)NC(=NC2=O)N

Isomeric SMILES

C(CCl)N(CCCl)/N=N/C1=NC2C(=N1)NC(=NC2=O)N

InChI

InChI=1S/C9H12Cl2N8O/c10-1-3-19(4-2-11)18-17-9-13-5-6(15-9)14-8(12)16-7(5)20/h5H,1-4H2,(H3,12,13,14,15,16,20)/b18-17+