N-(2-ethylphenyl)-2-fluoranyl-5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-benzamide

Systemtic Name: N-(2-ethylphenyl)-2-fluoranyl-5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-benzamide Openeye Name: N-(2-ethylphenyl)-2-fluoro-5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonyl-benzamide CAS Name: N-(2-ethylphenyl)-2-fluoro-5-[[4-(4-methoxyphenyl)-1-piperazinyl]sulfonyl]benzamide IUPAC Name: N-(2-ethylphenyl)-2-fluoro-5-[4-(4-methoxyphenyl)piperazin-1-yl]sulfonylbenzamide Traditional Name: N-(2-ethylphenyl)-2-fluoro-5-[4-(4-methoxyphenyl)piperazino]sulfonyl-benzamide Formula: C26H28FN3O4S MolecularWeight: 497.581623

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)F

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)F

InChI

InChI=1S/C26H28FN3O4S/c1-3-19-6-4-5-7-25(19)28-26(31)23-18-22(12-13-24(23)27)35(32,33)30-16-14-29(15-17-30)20-8-10-21(34-2)11-9-20/h4-13,18H,3,14-17H2,1-2H3,(H,28,31)