6-[(4-chlorophenyl)methylsulfanyl]pteridine-2,4,7-triamine

Systemtic Name: 6-[(4-chlorophenyl)methylsulfanyl]pteridine-2,4,7-triamine Openeye Name: 6-[(4-chlorophenyl)methylsulfanyl]pteridine-2,4,7-triamine CAS Name: 6-[(4-chlorophenyl)methylthio]pteridine-2,4,7-triamine IUPAC Name: 6-[(4-chlorophenyl)methylsulfanyl]pteridine-2,4,7-triamine Traditional Name: [2,4-diamino-6-[(4-chlorobenzyl)thio]pteridin-7-yl]amine Formula: C13H12ClN7S MolecularWeight: 333.79928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NC3=C(N=C2N)N=C(N=C3N)N)Cl

Isomeric SMILES

C1=CC(=CC=C1CSC2=NC3=C(N=C2N)N=C(N=C3N)N)Cl

InChI

InChI=1S/C13H12ClN7S/c14-7-3-1-6(2-4-7)5-22-12-10(16)19-11-8(18-12)9(15)20-13(17)21-11/h1-4H,5H2,(H6,15,16,17,19,20,21)