N-(4-butylphenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-(4-butylphenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-(4-butylphenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-(4-butylphenyl)-3-[(4-ethylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-(4-butylphenyl)-3-[(4-ethylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-(4-butylphenyl)-3-[(4-esylpiperazino)methyl]benzamide Formula: C24H33N3O3S MolecularWeight: 443.60212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)CC

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)CN3CCN(CC3)S(=O)(=O)CC

InChI

InChI=1S/C24H33N3O3S/c1-3-5-7-20-10-12-23(13-11-20)25-24(28)22-9-6-8-21(18-22)19-26-14-16-27(17-15-26)31(29,30)4-2/h6,8-13,18H,3-5,7,14-17,19H2,1-2H3,(H,25,28)