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

Systemtic Name: N-[6-azanyl-2-(2-methoxyethylsulfanyl)-4-oxidanylidene-1H-pyrimidin-5-yl]-4-bromanyl-benzamide Openeye Name: N-[6-amino-2-(2-methoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-bromo-benzamide CAS Name: N-[6-amino-2-(2-methoxyethylthio)-4-oxo-1H-pyrimidin-5-yl]-4-bromobenzamide IUPAC Name: N-[6-amino-2-(2-methoxyethylsulfanyl)-4-oxo-1H-pyrimidin-5-yl]-4-bromobenzamide Traditional Name: N-[6-amino-4-keto-2-(2-methoxyethylthio)-1H-pyrimidin-5-yl]-4-bromo-benzamide Formula: C14H15BrN4O3S MolecularWeight: 399.2629

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Descriptors Computed from Structure

Canonical SMILES:

COCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COCCSC1=NC(=O)C(=C(N1)N)NC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C14H15BrN4O3S/c1-22-6-7-23-14-18-11(16)10(13(21)19-14)17-12(20)8-2-4-9(15)5-3-8/h2-5H,6-7H2,1H3,(H,17,20)(H3,16,18,19,21)