3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile

Systemtic Name: 3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile Openeye Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-(4-fluorophenyl)sulfonyl-prop-2-enenitrile CAS Name: 3-[4-[ethyl-(phenylmethyl)amino]phenyl]-2-(4-fluorophenyl)sulfonyl-2-propenenitrile IUPAC Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-(4-fluorophenyl)sulfonylprop-2-enenitrile Traditional Name: 3-[4-[benzyl(ethyl)amino]phenyl]-2-(4-fluorophenyl)sulfonyl-acrylonitrile Formula: C24H21FN2O2S MolecularWeight: 420.499143

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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)C3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=CC=CC=C1)C2=CC=C(C=C2)C=C(C#N)S(=O)(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C24H21FN2O2S/c1-2-27(18-20-6-4-3-5-7-20)22-12-8-19(9-13-22)16-24(17-26)30(28,29)23-14-10-21(25)11-15-23/h3-16H,2,18H2,1H3