(E)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-methylsulfonyl-prop-2-enenitrile

Systemtic Name: (E)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-methylsulfonyl-prop-2-enenitrile Openeye Name: (E)-3-[4-[benzyl(ethyl)amino]phenyl]-2-methylsulfonyl-prop-2-enenitrile CAS Name: (E)-3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-methylsulfonyl-2-propenenitrile IUPAC Name: (E)-3-[4-[benzyl(ethyl)amino]phenyl]-2-methylsulfonylprop-2-enenitrile Traditional Name: (E)-3-[4-[benzyl(ethyl)amino]phenyl]-2-mesyl-acrylonitrile Formula: C19H20N2O2S MolecularWeight: 340.4393

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)/C=C(\C#N)/S(=O)(=O)C

InChI

InChI=1S/C19H20N2O2S/c1-3-21(15-17-7-5-4-6-8-17)18-11-9-16(10-12-18)13-19(14-20)24(2,22)23/h4-13H,3,15H2,1-2H3/b19-13+