1-[4-(5-bromanyl-2-methoxy-phenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone

Systemtic Name: 1-[4-(5-bromanyl-2-methoxy-phenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone Openeye Name: 1-[4-(5-bromo-2-methoxy-phenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]ethanone CAS Name: 1-[4-(5-bromo-2-methoxyphenyl)-6-methylene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone IUPAC Name: 1-[4-(5-bromo-2-methoxyphenyl)-6-methylidene-2-sulfanylidene-1,3-diazinan-5-yl]ethanone Traditional Name: 1-[4-(5-bromo-2-methoxy-phenyl)-6-methylene-2-thioxo-hexahydropyrimidin-5-yl]ethanone Formula: C14H15BrN2O2S MolecularWeight: 355.2501

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(NC(=S)NC1=C)C2=C(C=CC(=C2)Br)OC

Isomeric SMILES

CC(=O)C1C(NC(=S)NC1=C)C2=C(C=CC(=C2)Br)OC

InChI

InChI=1S/C14H15BrN2O2S/c1-7-12(8(2)18)13(17-14(20)16-7)10-6-9(15)4-5-11(10)19-3/h4-6,12-13H,1H2,2-3H3,(H2,16,17,20)