2-cyano-3-[3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]prop-2-enethioamide

Systemtic Name: 2-cyano-3-[3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]prop-2-enethioamide Openeye Name: 2-cyano-3-[3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]prop-2-enethioamide CAS Name: 2-cyano-3-[3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]-2-propenethioamide IUPAC Name: 2-cyano-3-[3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]prop-2-enethioamide Traditional Name: 2-cyano-3-[3-ethoxy-4-[2-nitro-4-(trifluoromethyl)phenoxy]phenyl]thioacrylamide Formula: C19H14F3N3O4S MolecularWeight: 437.39237

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H14F3N3O4S/c1-2-28-17-8-11(7-12(10-23)18(24)30)3-5-16(17)29-15-6-4-13(19(20,21)22)9-14(15)25(26)27/h3-9H,2H2,1H3,(H2,24,30)