N-[6-azanyl-2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-bromanyl-benzamide

Systemtic Name: N-[6-azanyl-2-(2-ethoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-bromanyl-benzamide Openeye Name: N-[6-amino-2-(2-ethoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-bromo-benzamide CAS Name: N-[6-amino-2-(2-ethoxyethylthio)-4-oxo-1H-pyrimidin-5-yl]-4-bromobenzamide IUPAC Name: N-[6-amino-2-(2-ethoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-bromobenzamide Traditional Name: N-[6-amino-2-(2-ethoxyethylthio)-4-keto-1H-pyrimidin-5-yl]-4-bromo-benzamide Formula: C15H17BrN4O3S MolecularWeight: 413.28948

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

CCOCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C15H17BrN4O3S/c1-2-23-7-8-24-15-19-12(17)11(14(22)20-15)18-13(21)9-3-5-10(16)6-4-9/h3-6H,2,7-8H2,1H3,(H,18,21)(H3,17,19,20,22)