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

Systemtic Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]-2-phenyl-pteridine-4,7-diamine Openeye Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]-2-phenyl-pteridine-4,7-diamine CAS Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]-2-phenylpteridine-4,7-diamine IUPAC Name: 6-[4-[bis(2-chloroethyl)amino]phenyl]-2-phenylpteridine-4,7-diamine Traditional Name: bis(2-chloroethyl)-[4-(4,7-diamino-2-phenyl-pteridin-6-yl)phenyl]amine Formula: C22H21Cl2N7 MolecularWeight: 454.35504

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=C(C(=N2)N)N=C(C(=N3)N)C4=CC=C(C=C4)N(CCCl)CCCl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=C(C(=N2)N)N=C(C(=N3)N)C4=CC=C(C=C4)N(CCCl)CCCl

InChI

InChI=1S/C22H21Cl2N7/c23-10-12-31(13-11-24)16-8-6-14(7-9-16)17-19(25)29-22-18(27-17)20(26)28-21(30-22)15-4-2-1-3-5-15/h1-9H,10-13H2,(H4,25,26,28,29,30)