N-(2-methoxyethyl)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-amine

Systemtic Name: N-(2-methoxyethyl)-6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-amine Openeye Name: N-(2-methoxyethyl)-5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-amine CAS Name: N-(2-methoxyethyl)-6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinamine IUPAC Name: N-(2-methoxyethyl)-6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-amine Traditional Name: 2-methoxyethyl-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]amine Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCCOC

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCCOC

InChI

InChI=1S/C14H16N4O3S/c1-10-3-5-11(6-4-10)22-14-12(18(19)20)13(16-9-17-14)15-7-8-21-2/h3-6,9H,7-8H2,1-2H3,(H,15,16,17)