N-ethyl-N-(3-methylphenyl)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-ethyl-N-(3-methylphenyl)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-amine Openeye Name: N-ethyl-N-(m-tolyl)-5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-amine CAS Name: N-ethyl-N-(3-methylphenyl)-6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinamine IUPAC Name: N-ethyl-N-(3-methylphenyl)-6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-amine Traditional Name: ethyl-(m-tolyl)-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]amine Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCN(C1=CC=CC(=C1)C)C2=C(C(=NC=N2)SC3=CC=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C20H20N4O2S/c1-4-23(16-7-5-6-15(3)12-16)19-18(24(25)26)20(22-13-21-19)27-17-10-8-14(2)9-11-17/h5-13H,4H2,1-3H3