N-[1-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide

Systemtic Name: N-[1-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxidanylidene-butan-2-yl]-4-fluoranyl-benzamide Openeye Name: N-[1-[4-(2-cyanophenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]-4-fluoro-benzamide CAS Name: N-[1-[4-(2-cyanophenyl)sulfonyl-1-piperazinyl]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide IUPAC Name: N-[1-[4-(2-cyanophenyl)sulfonylpiperazin-1-yl]-3-methyl-1-oxobutan-2-yl]-4-fluorobenzamide Traditional Name: N-[1-[4-(2-cyanophenyl)sulfonylpiperazine-1-carbonyl]-2-methyl-propyl]-4-fluoro-benzamide Formula: C23H25FN4O4S MolecularWeight: 472.532403

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N)NC(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CC(C)C(C(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C#N)NC(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C23H25FN4O4S/c1-16(2)21(26-22(29)17-7-9-19(24)10-8-17)23(30)27-11-13-28(14-12-27)33(31,32)20-6-4-3-5-18(20)15-25/h3-10,16,21H,11-14H2,1-2H3,(H,26,29)