1-[4-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[4-(3-bromanyl-5-methoxy-4-propan-2-yloxy-phenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Openeye Name: 1-[4-(3-bromo-4-isopropoxy-5-methoxy-phenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone CAS Name: 1-[4-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[4-(3-bromo-5-methoxy-4-propan-2-yloxyphenyl)-6-phenyl-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Traditional Name: 1-[4-(3-bromo-4-isopropoxy-5-methoxy-phenyl)-6-phenyl-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Formula: C22H23BrN2O3S MolecularWeight: 475.39862

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=C(C=C(C=C1Br)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C)OC

Isomeric SMILES

CC(C)OC1=C(C=C(C=C1Br)C2C(=C(NC(=S)N2)C3=CC=CC=C3)C(=O)C)OC

InChI

InChI=1S/C22H23BrN2O3S/c1-12(2)28-21-16(23)10-15(11-17(21)27-4)20-18(13(3)26)19(24-22(29)25-20)14-8-6-5-7-9-14/h5-12,20H,1-4H3,(H2,24,25,29)