4-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-(4-methylphenyl)sulfanyl-5-nitro-pyrimidin-4-yl]morpholine Openeye Name: 4-[5-nitro-6-(p-tolylsulfanyl)pyrimidin-4-yl]morpholine CAS Name: 4-[6-[(4-methylphenyl)thio]-5-nitro-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-(4-methylphenyl)sulfanyl-5-nitropyrimidin-4-yl]morpholine Traditional Name: 4-[5-nitro-6-(p-tolylthio)pyrimidin-4-yl]morpholine Formula: C15H16N4O3S MolecularWeight: 332.37754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])N3CCOCC3

InChI

InChI=1S/C15H16N4O3S/c1-11-2-4-12(5-3-11)23-15-13(19(20)21)14(16-10-17-15)18-6-8-22-9-7-18/h2-5,10H,6-9H2,1H3