1-[(4R)-6-(4-chlorophenyl)-4-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone

Systemtic Name: 1-[(4R)-6-(4-chlorophenyl)-4-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Openeye Name: 1-[(4R)-6-(4-chlorophenyl)-4-(3-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone CAS Name: 1-[(4R)-6-(4-chlorophenyl)-4-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone IUPAC Name: 1-[(4R)-6-(4-chlorophenyl)-4-(3-nitrophenyl)-2-sulfanylidene-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Traditional Name: 1-[(4R)-6-(4-chlorophenyl)-4-(3-nitrophenyl)-2-thioxo-3,4-dihydro-1H-pyrimidin-5-yl]ethanone Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(NC(=S)NC1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)C1=C(NC(=S)N[C@@H]1C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H14ClN3O3S/c1-10(23)15-16(11-5-7-13(19)8-6-11)20-18(26)21-17(15)12-3-2-4-14(9-12)22(24)25/h2-9,17H,1H3,(H2,20,21,26)/t17-/m1/s1