N-(4-ethylphenyl)-2-fluoranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(4-ethylphenyl)-2-fluoranyl-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(4-ethylphenyl)-2-fluoro-5-(4-phenylpiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(4-ethylphenyl)-2-fluoro-5-[(4-phenyl-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(4-ethylphenyl)-2-fluoro-5-(4-phenylpiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylphenyl)-2-fluoro-5-(4-phenylpiperazino)sulfonyl-benzamide Formula: C25H26FN3O3S MolecularWeight: 467.555643

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=CC=C4)F

Isomeric SMILES

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

InChI

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