N-(4-ethylphenyl)-3-(4-ethylpiperazin-1-yl)sulfonyl-4-fluoranyl-benzamide

Systemtic Name: N-(4-ethylphenyl)-3-(4-ethylpiperazin-1-yl)sulfonyl-4-fluoranyl-benzamide Openeye Name: N-(4-ethylphenyl)-3-(4-ethylpiperazin-1-yl)sulfonyl-4-fluoro-benzamide CAS Name: N-(4-ethylphenyl)-3-[(4-ethyl-1-piperazinyl)sulfonyl]-4-fluorobenzamide IUPAC Name: N-(4-ethylphenyl)-3-(4-ethylpiperazin-1-yl)sulfonyl-4-fluorobenzamide Traditional Name: N-(4-ethylphenyl)-3-(4-ethylpiperazino)sulfonyl-4-fluoro-benzamide Formula: C21H26FN3O3S MolecularWeight: 419.512843

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)CC

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)F)S(=O)(=O)N3CCN(CC3)CC

InChI

InChI=1S/C21H26FN3O3S/c1-3-16-5-8-18(9-6-16)23-21(26)17-7-10-19(22)20(15-17)29(27,28)25-13-11-24(4-2)12-14-25/h5-10,15H,3-4,11-14H2,1-2H3,(H,23,26)