2-ethoxy-1-[(4R)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone

Systemtic Name: 2-ethoxy-1-[(4R)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Openeye Name: 2-ethoxy-1-[(4R)-6-methyl-4-(3-phenoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone CAS Name: 2-ethoxy-1-[(4R)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone IUPAC Name: 2-ethoxy-1-[(4R)-6-methyl-4-(3-phenoxyphenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Traditional Name: 2-ethoxy-1-[(4R)-6-methyl-4-(3-phenoxyphenyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Formula: C21H22N2O3S MolecularWeight: 382.47598

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)OC3=CC=CC=C3)C

Isomeric SMILES

CCOCC(=O)C1=C(NC(=S)N[C@@H]1C2=CC(=CC=C2)OC3=CC=CC=C3)C

InChI

InChI=1S/C21H22N2O3S/c1-3-25-13-18(24)19-14(2)22-21(27)23-20(19)15-8-7-11-17(12-15)26-16-9-5-4-6-10-16/h4-12,20H,3,13H2,1-2H3,(H2,22,23,27)/t20-/m1/s1