N-(3-methoxyphenyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(3-methoxyphenyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-(3-methoxyphenyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-(3-methoxyphenyl)-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-(3-methoxyphenyl)-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: (3-methoxyphenyl)-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)NC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

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