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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)F

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCN(CC3)C4=CC=C(C=C4)OC)F

InChI

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