6-azanyl-5-nitroso-2-(2-propoxy-5-propylsulfonyl-phenyl)-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-5-nitroso-2-(2-propoxy-5-propylsulfonyl-phenyl)-1H-pyrimidin-4-one Openeye Name: 6-amino-5-nitroso-2-(2-propoxy-5-propylsulfonyl-phenyl)-1H-pyrimidin-4-one CAS Name: 6-amino-5-nitroso-2-(2-propoxy-5-propylsulfonylphenyl)-1H-pyrimidin-4-one IUPAC Name: 6-amino-5-nitroso-2-(2-propoxy-5-propylsulfonylphenyl)-1H-pyrimidin-4-one Traditional Name: 6-amino-5-nitroso-2-(2-propoxy-5-propylsulfonyl-phenyl)-1H-pyrimidin-4-one Formula: C16H20N4O5S MolecularWeight: 380.4188

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)CCC)C2=NC(=O)C(=C(N2)N)N=O

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)CCC)C2=NC(=O)C(=C(N2)N)N=O

InChI

InChI=1S/C16H20N4O5S/c1-3-7-25-12-6-5-10(26(23,24)8-4-2)9-11(12)15-18-14(17)13(20-22)16(21)19-15/h5-6,9H,3-4,7-8H2,1-2H3,(H3,17,18,19,21)