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

Systemtic Name: 6-[[2-(furan-2-yl)quinazolin-4-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Openeye Name: 6-[[2-(2-furyl)quinazolin-4-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine CAS Name: 6-[[[2-(2-furanyl)-4-quinazolinyl]thio]methyl]-1,3,5-triazine-2,4-diamine IUPAC Name: 6-[[2-(furan-2-yl)quinazolin-4-yl]sulfanylmethyl]-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[[[2-(2-furyl)quinazolin-4-yl]thio]methyl]-s-triazin-2-yl]amine Formula: C16H13N7OS MolecularWeight: 351.38572

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CO3)SCC4=NC(=NC(=N4)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=N2)C3=CC=CO3)SCC4=NC(=NC(=N4)N)N

InChI

InChI=1S/C16H13N7OS/c17-15-20-12(21-16(18)23-15)8-25-14-9-4-1-2-5-10(9)19-13(22-14)11-6-3-7-24-11/h1-7H,8H2,(H4,17,18,20,21,23)