4-(4-bromophenyl)-2-oxidanylidene-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile; 4-methylmorpholine

Systemtic Name: 4-(4-bromophenyl)-2-oxidanylidene-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile; 4-methylmorpholine Openeye Name: 4-(4-bromophenyl)-2-oxo-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile; 4-methylmorpholine CAS Name: 4-(4-bromophenyl)-6-mercapto-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile; 4-methylmorpholine IUPAC Name: 4-(4-bromophenyl)-2-oxo-6-sulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile; 4-methylmorpholine Traditional Name: 4-(4-bromophenyl)-2-keto-6-mercapto-3,4-dihydro-1H-pyridine-5-carbonitrile; 4-methylmorpholine Formula: C17H20BrN3O2S MolecularWeight: 410.3286

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCOCC1.C1C(C(=C(NC1=O)S)C#N)C2=CC=C(C=C2)Br

Isomeric SMILES

CN1CCOCC1.C1C(C(=C(NC1=O)S)C#N)C2=CC=C(C=C2)Br

InChI

InChI=1S/C12H9BrN2OS.C5H11NO/c13-8-3-1-7(2-4-8)9-5-11(16)15-12(17)10(9)6-14;1-6-2-4-7-5-3-6/h1-4,9,17H,5H2,(H,15,16);2-5H2,1H3