2-azanyl-4-(1-azanyl-3-oxidanyl-propan-2-yl)sulfanyl-5-bromanyl-1H-pyrimidin-6-one

Systemtic Name: 2-azanyl-4-(1-azanyl-3-oxidanyl-propan-2-yl)sulfanyl-5-bromanyl-1H-pyrimidin-6-one Openeye Name: 2-amino-4-[1-(aminomethyl)-2-hydroxy-ethyl]sulfanyl-5-bromo-1H-pyrimidin-6-one CAS Name: 2-amino-4-[(1-amino-3-hydroxypropan-2-yl)thio]-5-bromo-1H-pyrimidin-6-one IUPAC Name: 2-amino-4-(1-amino-3-hydroxypropan-2-yl)sulfanyl-5-bromo-1H-pyrimidin-6-one Traditional Name: 2-amino-4-[[1-(aminomethyl)-2-hydroxy-ethyl]thio]-5-bromo-1H-pyrimidin-6-one Formula: C7H11BrN4O2S MolecularWeight: 295.15684

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CO)SC1=C(C(=O)NC(=N1)N)Br)N

Isomeric SMILES

C(C(CO)SC1=C(C(=O)NC(=N1)N)Br)N

InChI

InChI=1S/C7H11BrN4O2S/c8-4-5(14)11-7(10)12-6(4)15-3(1-9)2-13/h3,13H,1-2,9H2,(H3,10,11,12,14)