N-cyclooctyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide

Systemtic Name: N-cyclooctyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Openeye Name: N-cyclooctyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide CAS Name: N-cyclooctyl-3-[(4-methylsulfonyl-1-piperazinyl)methyl]benzamide IUPAC Name: N-cyclooctyl-3-[(4-methylsulfonylpiperazin-1-yl)methyl]benzamide Traditional Name: N-cyclooctyl-3-[(4-mesylpiperazino)methyl]benzamide Formula: C21H33N3O3S MolecularWeight: 407.57002

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3CCCCCCC3

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)CC2=CC=CC(=C2)C(=O)NC3CCCCCCC3

InChI

InChI=1S/C21H33N3O3S/c1-28(26,27)24-14-12-23(13-15-24)17-18-8-7-9-19(16-18)21(25)22-20-10-5-3-2-4-6-11-20/h7-9,16,20H,2-6,10-15,17H2,1H3,(H,22,25)