4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide

Systemtic Name: 4-(3-bromanyl-5-ethoxy-4-oxidanyl-phenyl)-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Openeye Name: 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-N,N-diethyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide CAS Name: 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide IUPAC Name: 4-(3-bromo-5-ethoxy-4-hydroxyphenyl)-N,N-diethyl-6-methyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidine-5-carboxamide Traditional Name: 4-(3-bromo-5-ethoxy-4-hydroxy-phenyl)-N,N-diethyl-6-methyl-2-thioxo-3,4-dihydro-1H-pyrimidine-5-carboxamide Formula: C18H24BrN3O3S MolecularWeight: 442.37046

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=C(NC(=S)NC1C2=CC(=C(C(=C2)Br)O)OCC)C

Isomeric SMILES

CCN(CC)C(=O)C1=C(NC(=S)NC1C2=CC(=C(C(=C2)Br)O)OCC)C

InChI

InChI=1S/C18H24BrN3O3S/c1-5-22(6-2)17(24)14-10(4)20-18(26)21-15(14)11-8-12(19)16(23)13(9-11)25-7-3/h8-9,15,23H,5-7H2,1-4H3,(H2,20,21,26)