(Z)-3-(1,3-benzodioxol-5-yl)-2-(1-methylimidazol-2-yl)sulfonyl-prop-2-enenitrile

Systemtic Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-(1-methylimidazol-2-yl)sulfonyl-prop-2-enenitrile Openeye Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-(1-methylimidazol-2-yl)sulfonyl-prop-2-enenitrile CAS Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-[(1-methyl-2-imidazolyl)sulfonyl]-2-propenenitrile IUPAC Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-(1-methylimidazol-2-yl)sulfonylprop-2-enenitrile Traditional Name: (Z)-3-(1,3-benzodioxol-5-yl)-2-(1-methylimidazol-2-yl)sulfonyl-acrylonitrile Formula: C14H11N3O4S MolecularWeight: 317.31984

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1S(=O)(=O)C(=CC2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

CN1C=CN=C1S(=O)(=O)/C(=C\C2=CC3=C(C=C2)OCO3)/C#N

InChI

InChI=1S/C14H11N3O4S/c1-17-5-4-16-14(17)22(18,19)11(8-15)6-10-2-3-12-13(7-10)21-9-20-12/h2-7H,9H2,1H3/b11-6-