N-(1-methoxypropan-2-yl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(1-methoxypropan-2-yl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-(2-methoxy-1-methyl-ethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-(1-methoxypropan-2-yl)-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-(1-methoxypropan-2-yl)-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: (2-methoxy-1-methyl-ethyl)-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C14H16N4O3S MolecularWeight: 320.36684

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC)NC1=C(C(=NC=N1)SC2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC(COC)NC1=C(C(=NC=N1)SC2=CC=CC=C2)[N+](=O)[O-]

InChI

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