N-(4-bromophenyl)-2-[5-methoxy-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]ethanamide

Systemtic Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxidanylidene-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]ethanamide Openeye Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)-1-pyridyl]acetamide CAS Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxo-2-[(2-pyrimidinylthio)methyl]-1-pyridinyl]acetamide IUPAC Name: N-(4-bromophenyl)-2-[5-methoxy-4-oxo-2-(pyrimidin-2-ylsulfanylmethyl)pyridin-1-yl]acetamide Traditional Name: N-(4-bromophenyl)-2-[4-keto-5-methoxy-2-[(2-pyrimidylthio)methyl]-1-pyridyl]acetamide Formula: C19H17BrN4O3S MolecularWeight: 461.33228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CN(C(=CC1=O)CSC2=NC=CC=N2)CC(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

COC1=CN(C(=CC1=O)CSC2=NC=CC=N2)CC(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C19H17BrN4O3S/c1-27-17-10-24(11-18(26)23-14-5-3-13(20)4-6-14)15(9-16(17)25)12-28-19-21-7-2-8-22-19/h2-10H,11-12H2,1H3,(H,23,26)