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

Systemtic Name: 6-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[(1-phenyltetrazol-5-yl)thio]methyl]-s-triazin-2-yl]amine Formula: C11H11N9S MolecularWeight: 301.33034

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)SCC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C11H11N9S/c12-9-14-8(15-10(13)16-9)6-21-11-17-18-19-20(11)7-4-2-1-3-5-7/h1-5H,6H2,(H4,12,13,14,15,16)