5-[3-(4-aminophenyl)sulfanylpropyl]pyrimidine-2,4,6-triamine

Systemtic Name: 5-[3-(4-aminophenyl)sulfanylpropyl]pyrimidine-2,4,6-triamine Openeye Name: 5-[3-(4-aminophenyl)sulfanylpropyl]pyrimidine-2,4,6-triamine CAS Name: 5-[3-[(4-aminophenyl)thio]propyl]pyrimidine-2,4,6-triamine IUPAC Name: 5-[3-(4-aminophenyl)sulfanylpropyl]pyrimidine-2,4,6-triamine Traditional Name: [2,6-diamino-5-[3-[(4-aminophenyl)thio]propyl]pyrimidin-4-yl]amine Formula: C13H18N6S MolecularWeight: 290.38722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N)SCCCC2=C(N=C(N=C2N)N)N

Isomeric SMILES

C1=CC(=CC=C1N)SCCCC2=C(N=C(N=C2N)N)N

InChI

InChI=1S/C13H18N6S/c14-8-3-5-9(6-4-8)20-7-1-2-10-11(15)18-13(17)19-12(10)16/h3-6H,1-2,7,14H2,(H6,15,16,17,18,19)