N-(4-methylsulfanylphenyl)-6-(4-nitrophenoxy)pyrimidin-4-amine

Systemtic Name: N-(4-methylsulfanylphenyl)-6-(4-nitrophenoxy)pyrimidin-4-amine Openeye Name: N-(4-methylsulfanylphenyl)-6-(4-nitrophenoxy)pyrimidin-4-amine CAS Name: N-[4-(methylthio)phenyl]-6-(4-nitrophenoxy)-4-pyrimidinamine IUPAC Name: N-(4-methylsulfanylphenyl)-6-(4-nitrophenoxy)pyrimidin-4-amine Traditional Name: [4-(methylthio)phenyl]-[6-(4-nitrophenoxy)pyrimidin-4-yl]amine Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)NC2=CC(=NC=N2)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CSC1=CC=C(C=C1)NC2=CC(=NC=N2)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O3S/c1-25-15-8-2-12(3-9-15)20-16-10-17(19-11-18-16)24-14-6-4-13(5-7-14)21(22)23/h2-11H,1H3,(H,18,19,20)