N-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-ethanamide

Systemtic Name: N-[(E)-(4-methoxy-3-nitro-phenyl)methylideneamino]-2-pyrimidin-2-ylsulfanyl-ethanamide Openeye Name: N-[(E)-(4-methoxy-3-nitro-phenyl)methyleneamino]-2-pyrimidin-2-ylsulfanyl-acetamide CAS Name: N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-2-(2-pyrimidinylthio)acetamide IUPAC Name: N-[(E)-(4-methoxy-3-nitrophenyl)methylideneamino]-2-pyrimidin-2-ylsulfanylacetamide Traditional Name: N-[(E)-(4-methoxy-3-nitro-benzylidene)amino]-2-(2-pyrimidylthio)acetamide Formula: C14H13N5O4S MolecularWeight: 347.34912

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C=NNC(=O)CSC2=NC=CC=N2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)/C=N/NC(=O)CSC2=NC=CC=N2)[N+](=O)[O-]

InChI

InChI=1S/C14H13N5O4S/c1-23-12-4-3-10(7-11(12)19(21)22)8-17-18-13(20)9-24-14-15-5-2-6-16-14/h2-8H,9H2,1H3,(H,18,20)/b17-8+