(Z)-2-cyclopropylcarbonyl-3-[(4-methylsulfonylphenyl)amino]-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-cyclopropylcarbonyl-3-[(4-methylsulfonylphenyl)amino]-3-oxidanyl-prop-2-enenitrile Openeye Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-(4-methylsulfonylanilino)prop-2-enenitrile CAS Name: (Z)-2-[cyclopropyl(oxo)methyl]-3-hydroxy-3-(4-methylsulfonylanilino)-2-propenenitrile IUPAC Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-(4-methylsulfonylanilino)prop-2-enenitrile Traditional Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-(4-mesylanilino)acrylonitrile Formula: C14H14N2O4S MolecularWeight: 306.33696

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=C(C=C1)NC(=C(C#N)C(=O)C2CC2)O

Isomeric SMILES

CS(=O)(=O)C1=CC=C(C=C1)N/C(=C(\C#N)/C(=O)C2CC2)/O

InChI

InChI=1S/C14H14N2O4S/c1-21(19,20)11-6-4-10(5-7-11)16-14(18)12(8-15)13(17)9-2-3-9/h4-7,9,16,18H,2-3H2,1H3/b14-12-