(2R)-N-(2-nitrophenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide

Systemtic Name: (2R)-N-(2-nitrophenyl)-2-[(6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanamide Openeye Name: (2R)-N-(2-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide CAS Name: (2R)-N-(2-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)thio]propanamide IUPAC Name: (2R)-N-(2-nitrophenyl)-2-[(6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanamide Traditional Name: (2R)-2-[(6-keto-1H-pyrimidin-2-yl)thio]-N-(2-nitrophenyl)propionamide Formula: C13H12N4O4S MolecularWeight: 320.32378

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NC=CC(=O)N2

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1[N+](=O)[O-])SC2=NC=CC(=O)N2

InChI

InChI=1S/C13H12N4O4S/c1-8(22-13-14-7-6-11(18)16-13)12(19)15-9-4-2-3-5-10(9)17(20)21/h2-8H,1H3,(H,15,19)(H,14,16,18)/t8-/m1/s1