N-(2-ethylphenyl)-4-fluoranyl-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(2-ethylphenyl)-4-fluoranyl-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(2-ethylphenyl)-4-fluoro-3-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(2-ethylphenyl)-4-fluoro-3-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(2-ethylphenyl)-4-fluoro-3-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(2-ethylphenyl)-4-fluoro-3-(4-phenylpiperazino)sulfonyl-benzamide Formula: C25H26FN3O3S MolecularWeight: 467.555643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26FN3O3S/c1-2-19-8-6-7-11-23(19)27-25(30)20-12-13-22(26)24(18-20)33(31,32)29-16-14-28(15-17-29)21-9-4-3-5-10-21/h3-13,18H,2,14-17H2,1H3,(H,27,30)