N-(2-methoxy-5-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-propanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-pyrimidin-2-ylsulfanyl-propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-(2-pyrimidinylthio)propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-pyrimidin-2-ylsulfanylpropanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-(2-pyrimidylthio)propionamide Formula: C14H14N4O4S MolecularWeight: 334.35036

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H14N4O4S/c1-9(23-14-15-6-3-7-16-14)13(19)17-11-8-10(18(20)21)4-5-12(11)22-2/h3-9H,1-2H3,(H,17,19)