6-(2-propan-2-ylphenyl)sulfanylpteridine-2,4-diamine

Systemtic Name: 6-(2-propan-2-ylphenyl)sulfanylpteridine-2,4-diamine Openeye Name: 6-(2-isopropylphenyl)sulfanylpteridine-2,4-diamine CAS Name: 6-[(2-propan-2-ylphenyl)thio]pteridine-2,4-diamine IUPAC Name: 6-(2-propan-2-ylphenyl)sulfanylpteridine-2,4-diamine Traditional Name: [2-amino-6-(o-cumenylthio)pteridin-4-yl]amine Formula: C15H16N6S MolecularWeight: 312.39274

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1SC2=CN=C3C(=N2)C(=NC(=N3)N)N

Isomeric SMILES

CC(C)C1=CC=CC=C1SC2=CN=C3C(=N2)C(=NC(=N3)N)N

InChI

InChI=1S/C15H16N6S/c1-8(2)9-5-3-4-6-10(9)22-11-7-18-14-12(19-11)13(16)20-15(17)21-14/h3-8H,1-2H3,(H4,16,17,18,20,21)