(E)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]carbonyl-3-(4-propan-2-ylphenyl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(2-fluorophenyl)sulfonylpiperazin-1-yl]carbonyl-3-(4-propan-2-ylphenyl)prop-2-enenitrile Openeye Name: (E)-2-[4-(2-fluorophenyl)sulfonylpiperazine-1-carbonyl]-3-(4-isopropylphenyl)prop-2-enenitrile CAS Name: (E)-2-[[4-(2-fluorophenyl)sulfonyl-1-piperazinyl]-oxomethyl]-3-(4-propan-2-ylphenyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(2-fluorophenyl)sulfonylpiperazine-1-carbonyl]-3-(4-propan-2-ylphenyl)prop-2-enenitrile Traditional Name: (E)-2-[4-(2-fluorophenyl)sulfonylpiperazine-1-carbonyl]-3-p-cumenyl-acrylonitrile Formula: C23H24FN3O3S MolecularWeight: 441.518363

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C=C(C#N)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

Isomeric SMILES

CC(C)C1=CC=C(C=C1)/C=C(\C#N)/C(=O)N2CCN(CC2)S(=O)(=O)C3=CC=CC=C3F

InChI

InChI=1S/C23H24FN3O3S/c1-17(2)19-9-7-18(8-10-19)15-20(16-25)23(28)26-11-13-27(14-12-26)31(29,30)22-6-4-3-5-21(22)24/h3-10,15,17H,11-14H2,1-2H3/b20-15+