6-(1,3-benzoxazol-2-ylsulfanylmethyl)-N2-phenyl-1,3,5-triazine-2,4-diamine

Systemtic Name: 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-N2-phenyl-1,3,5-triazine-2,4-diamine Openeye Name: 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-N2-phenyl-1,3,5-triazine-2,4-diamine CAS Name: 6-[(1,3-benzoxazol-2-ylthio)methyl]-N2-phenyl-1,3,5-triazine-2,4-diamine IUPAC Name: 6-(1,3-benzoxazol-2-ylsulfanylmethyl)-2-N-phenyl-1,3,5-triazine-2,4-diamine Traditional Name: [4-amino-6-[(1,3-benzoxazol-2-ylthio)methyl]-s-triazin-2-yl]-phenyl-amine Formula: C17H14N6OS MolecularWeight: 350.39766

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C17H14N6OS/c18-15-21-14(22-16(23-15)19-11-6-2-1-3-7-11)10-25-17-20-12-8-4-5-9-13(12)24-17/h1-9H,10H2,(H3,18,19,21,22,23)