4-azanyl-1-[(4-bromanylthiophen-2-yl)methyl]-5-nitro-pyrimidin-2-one

Systemtic Name: 4-azanyl-1-[(4-bromanylthiophen-2-yl)methyl]-5-nitro-pyrimidin-2-one Openeye Name: 4-amino-1-[(4-bromo-2-thienyl)methyl]-5-nitro-pyrimidin-2-one CAS Name: 4-amino-1-[(4-bromo-2-thiophenyl)methyl]-5-nitro-2-pyrimidinone IUPAC Name: 4-amino-1-[(4-bromothiophen-2-yl)methyl]-5-nitropyrimidin-2-one Traditional Name: 4-amino-1-[(4-bromo-2-thienyl)methyl]-5-nitro-pyrimidin-2-one Formula: C9H7BrN4O3S MolecularWeight: 331.14588

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(SC=C1Br)CN2C=C(C(=NC2=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=C(SC=C1Br)CN2C=C(C(=NC2=O)N)[N+](=O)[O-]

InChI

InChI=1S/C9H7BrN4O3S/c10-5-1-6(18-4-5)2-13-3-7(14(16)17)8(11)12-9(13)15/h1,3-4H,2H2,(H2,11,12,15)