(2R)-N-(4-fluoranyl-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: (2R)-N-(4-fluoranyl-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: (2R)-N-(4-fluoro-3-nitro-phenyl)-2-(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanyl-propanamide CAS Name: (2R)-N-(4-fluoro-3-nitrophenyl)-2-[(4-methyl-6-phenyl-2-pyrimidinyl)thio]propanamide IUPAC Name: (2R)-N-(4-fluoro-3-nitrophenyl)-2-(4-methyl-6-phenylpyrimidin-2-yl)sulfanylpropanamide Traditional Name: (2R)-N-(4-fluoro-3-nitro-phenyl)-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]propionamide Formula: C20H17FN4O3S MolecularWeight: 412.437383

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SC(C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)S[C@H](C)C(=O)NC3=CC(=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C20H17FN4O3S/c1-12-10-17(14-6-4-3-5-7-14)24-20(22-12)29-13(2)19(26)23-15-8-9-16(21)18(11-15)25(27)28/h3-11,13H,1-2H3,(H,23,26)/t13-/m1/s1