6-[4-[bis(2-chloroethyl)amino]phenyl]pteridine-4,7-diamine

Systemtic Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]pteridine-4,7-diamine Openeye Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]pteridine-4,7-diamine CAS Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]pteridine-4,7-diamine IUPAC Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]pteridine-4,7-diamine Traditional Name: bis(2-chloroethyl)-[4-(4,7-diaminopteridin-6-yl)phenyl]amine Formula: C16H17Cl2N7 MolecularWeight: 378.25908

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N=CN=C3N)N=C2N)N(CCCl)CCCl

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N=CN=C3N)N=C2N)N(CCCl)CCCl

InChI

InChI=1S/C16H17Cl2N7/c17-5-7-25(8-6-18)11-3-1-10(2-4-11)12-15(20)24-16-13(23-12)14(19)21-9-22-16/h1-4,9H,5-8H2,(H4,19,20,21,22,24)