6-(quinolin-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(quinolin-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Openeye Name: 6-(2-quinolylsulfanylmethyl)-1,3,5-triazine-2,4-diamine CAS Name: 6-[(2-quinolinylthio)methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(quinolin-2-ylsulfanylmethyl)-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(2-quinolylthio)methyl]-s-triazin-2-yl]amine Formula: C13H12N6S MolecularWeight: 284.33958

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=N2)SCC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=N2)SCC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C13H12N6S/c14-12-17-10(18-13(15)19-12)7-20-11-6-5-8-3-1-2-4-9(8)16-11/h1-6H,7H2,(H4,14,15,17,18,19)