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1-[3-[(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)amino]phenyl]ethanone

1-[3-[(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)amino]phenyl]ethanone

Systemtic Name:1-[3-[(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)amino]phenyl]ethanone
Openeye Name:1-[3-[(5-nitro-6-phenylsulfanyl-pyrimidin-4-yl)amino]phenyl]ethanone
CAS Name:1-[3-[[5-nitro-6-(phenylthio)-4-pyrimidinyl]amino]phenyl]ethanone
IUPAC Name:1-[3-[(5-nitro-6-phenylsulfanylpyrimidin-4-yl)amino]phenyl]ethanone
Traditional Name:1-[3-[[5-nitro-6-(phenylthio)pyrimidin-4-yl]amino]phenyl]ethanone
Formula: C18H14N4O3S
MolecularWeight: 366.39376
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C18H14N4O3S/c1-12(23)13-6-5-7-14(10-13)21-17-16(22(24)25)18(20-11-19-17)26-15-8-3-2-4-9-15/h2-11H,1H3,(H,19,20,21)


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