2-[1-(1-phenyl-1,2,3,4-tetrazol-5-yl)ethylsulfanyl]pyrimidine-4,6-diamine

Systemtic Name: 2-[1-(1-phenyl-1,2,3,4-tetrazol-5-yl)ethylsulfanyl]pyrimidine-4,6-diamine Openeye Name: 2-[1-(1-phenyltetrazol-5-yl)ethylsulfanyl]pyrimidine-4,6-diamine CAS Name: 2-[1-(1-phenyl-5-tetrazolyl)ethylthio]pyrimidine-4,6-diamine IUPAC Name: 2-[1-(1-phenyltetrazol-5-yl)ethylsulfanyl]pyrimidine-4,6-diamine Traditional Name: [6-amino-2-[1-(1-phenyltetrazol-5-yl)ethylthio]pyrimidin-4-yl]amine Formula: C13H14N8S MolecularWeight: 314.36886

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NN=NN1C2=CC=CC=C2)SC3=NC(=CC(=N3)N)N

Isomeric SMILES

CC(C1=NN=NN1C2=CC=CC=C2)SC3=NC(=CC(=N3)N)N

InChI

InChI=1S/C13H14N8S/c1-8(22-13-16-10(14)7-11(15)17-13)12-18-19-20-21(12)9-5-3-2-4-6-9/h2-8H,1H3,(H4,14,15,16,17)