2-azanylidene-6-[(4-chlorophenyl)sulfanylmethyl]-8-oxidanyl-pteridin-4-amine

Systemtic Name: 2-azanylidene-6-[(4-chlorophenyl)sulfanylmethyl]-8-oxidanyl-pteridin-4-amine Openeye Name: 6-[(4-chlorophenyl)sulfanylmethyl]-8-hydroxy-2-imino-pteridin-4-amine CAS Name: 6-[[(4-chlorophenyl)thio]methyl]-8-hydroxy-2-imino-4-pteridinamine IUPAC Name: 6-[(4-chlorophenyl)sulfanylmethyl]-8-hydroxy-2-iminopteridin-4-amine Traditional Name: [6-[[(4-chlorophenyl)thio]methyl]-8-hydroxy-2-imino-pteridin-4-yl]amine Formula: C13H11ClN6OS MolecularWeight: 334.78404

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1SCC2=CN(C3=NC(=N)N=C(C3=N2)N)O)Cl

Isomeric SMILES

C1=CC(=CC=C1SCC2=CN(C3=NC(=N)N=C(C3=N2)N)O)Cl

InChI

InChI=1S/C13H11ClN6OS/c14-7-1-3-9(4-2-7)22-6-8-5-20(21)12-10(17-8)11(15)18-13(16)19-12/h1-5,21H,6H2,(H3,15,16,18)