(Z)-3-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-methylimidazol-4-yl)sulfonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-methylimidazol-4-yl)sulfonyl-prop-2-enenitrile Openeye Name: (Z)-3-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-methylimidazol-4-yl)sulfonyl-prop-2-enenitrile CAS Name: (Z)-3-[2-[(4-chlorophenyl)thio]phenyl]-2-[(3-methyl-4-imidazolyl)sulfonyl]-2-propenenitrile IUPAC Name: (Z)-3-[2-(4-chlorophenyl)sulfanylphenyl]-2-(3-methylimidazol-4-yl)sulfonylprop-2-enenitrile Traditional Name: (Z)-3-[2-[(4-chlorophenyl)thio]phenyl]-2-(3-methylimidazol-4-yl)sulfonyl-acrylonitrile Formula: C19H14ClN3O2S2 MolecularWeight: 415.91636

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1S(=O)(=O)C(=CC2=CC=CC=C2SC3=CC=C(C=C3)Cl)C#N

Isomeric SMILES

CN1C=NC=C1S(=O)(=O)/C(=C\C2=CC=CC=C2SC3=CC=C(C=C3)Cl)/C#N

InChI

InChI=1S/C19H14ClN3O2S2/c1-23-13-22-12-19(23)27(24,25)17(11-21)10-14-4-2-3-5-18(14)26-16-8-6-15(20)7-9-16/h2-10,12-13H,1H3/b17-10-