(Z)-1-ethoxy-2-[methyl-[(3-methyl-1-phenyl-5-prop-2-enylsulfanyl-pyrazol-4-yl)methylidene]azaniumyl]ethenolate

Systemtic Name: (Z)-1-ethoxy-2-[methyl-[(3-methyl-1-phenyl-5-prop-2-enylsulfanyl-pyrazol-4-yl)methylidene]azaniumyl]ethenolate Openeye Name: (Z)-2-[(5-allylsulfanyl-3-methyl-1-phenyl-pyrazol-4-yl)methylene-methyl-ammonio]-1-ethoxy-ethenolate CAS Name: (Z)-1-ethoxy-2-[methyl-[[3-methyl-1-phenyl-5-(prop-2-enylthio)-4-pyrazolyl]methylidene]ammonio]ethenolate IUPAC Name: (Z)-1-ethoxy-2-[methyl-[(3-methyl-1-phenyl-5-prop-2-enylsulfanylpyrazol-4-yl)methylidene]azaniumyl]ethenolate Traditional Name: (Z)-2-[[5-(allylthio)-3-methyl-1-phenyl-pyrazol-4-yl]methylene-methyl-ammonio]-1-ethoxy-ethenolate Formula: C19H23N3O2S MolecularWeight: 357.46982

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=C[N+](=CC1=C(N(N=C1C)C2=CC=CC=C2)SCC=C)C)[O-]

Isomeric SMILES

CCO/C(=C\[N+](=CC1=C(N(N=C1C)C2=CC=CC=C2)SCC=C)C)/[O-]

InChI

InChI=1S/C19H23N3O2S/c1-5-12-25-19-17(13-21(4)14-18(23)24-6-2)15(3)20-22(19)16-10-8-7-9-11-16/h5,7-11,13-14H,1,6,12H2,2-4H3/b18-14-