2-cyano-3-[3-ethoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]prop-2-enethioamide

Systemtic Name: 2-cyano-3-[3-ethoxy-4-(5-nitropyridin-2-yl)oxy-phenyl]prop-2-enethioamide Openeye Name: 2-cyano-3-[3-ethoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]prop-2-enethioamide CAS Name: 2-cyano-3-[3-ethoxy-4-[(5-nitro-2-pyridinyl)oxy]phenyl]-2-propenethioamide IUPAC Name: 2-cyano-3-[3-ethoxy-4-(5-nitropyridin-2-yl)oxyphenyl]prop-2-enethioamide Traditional Name: 2-cyano-3-[3-ethoxy-4-[(5-nitro-2-pyridyl)oxy]phenyl]thioacrylamide Formula: C17H14N4O4S MolecularWeight: 370.38246

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C(=S)N)OC2=NC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C(=S)N)OC2=NC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H14N4O4S/c1-2-24-15-8-11(7-12(9-18)17(19)26)3-5-14(15)25-16-6-4-13(10-20-16)21(22)23/h3-8,10H,2H2,1H3,(H2,19,26)