6-azanyl-2-(2-butylsulfonylphenyl)-5-nitroso-1H-pyrimidin-4-one

Systemtic Name: 6-azanyl-2-(2-butylsulfonylphenyl)-5-nitroso-1H-pyrimidin-4-one Openeye Name: 6-amino-2-(2-butylsulfonylphenyl)-5-nitroso-1H-pyrimidin-4-one CAS Name: 6-amino-2-(2-butylsulfonylphenyl)-5-nitroso-1H-pyrimidin-4-one IUPAC Name: 6-amino-2-(2-butylsulfonylphenyl)-5-nitroso-1H-pyrimidin-4-one Traditional Name: 6-amino-2-(2-butylsulfonylphenyl)-5-nitroso-1H-pyrimidin-4-one Formula: C14H16N4O4S MolecularWeight: 336.36624

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)C1=CC=CC=C1C2=NC(=O)C(=C(N2)N)N=O

Isomeric SMILES

CCCCS(=O)(=O)C1=CC=CC=C1C2=NC(=O)C(=C(N2)N)N=O

InChI

InChI=1S/C14H16N4O4S/c1-2-3-8-23(21,22)10-7-5-4-6-9(10)13-16-12(15)11(18-20)14(19)17-13/h4-7H,2-3,8H2,1H3,(H3,15,16,17,19)