N4,N4-bis(2-chloroethyl)pyrimidine-2,4-diamine hydrochloride

Systemtic Name: N4,N4-bis(2-chloroethyl)pyrimidine-2,4-diamine hydrochloride Openeye Name: N4,N4-bis(2-chloroethyl)pyrimidine-2,4-diamine hydrochloride CAS Name: N4,N4-bis(2-chloroethyl)pyrimidine-2,4-diamine hydrochloride IUPAC Name: 4-N,4-N-bis(2-chloroethyl)pyrimidine-2,4-diamine hydrochloride Traditional Name: (2-aminopyrimidin-4-yl)-bis(2-chloroethyl)amine hydrochloride Formula: C8H13Cl3N4 MolecularWeight: 271.57462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1N(CCCl)CCCl)N.Cl

Isomeric SMILES

C1=CN=C(N=C1N(CCCl)CCCl)N.Cl

InChI

InChI=1S/C8H12Cl2N4.ClH/c9-2-5-14(6-3-10)7-1-4-12-8(11)13-7;/h1,4H,2-3,5-6H2,(H2,11,12,13);1H