4-butoxy-N-[4-[(2S)-2-pyridin-3-ylpiperidin-1-yl]sulfonylphenyl]benzamide

Systemtic Name: 4-butoxy-N-[4-[(2S)-2-pyridin-3-ylpiperidin-1-yl]sulfonylphenyl]benzamide Openeye Name: 4-butoxy-N-[4-[[(2S)-2-(3-pyridyl)-1-piperidyl]sulfonyl]phenyl]benzamide CAS Name: 4-butoxy-N-[4-[[(2S)-2-(3-pyridinyl)-1-piperidinyl]sulfonyl]phenyl]benzamide IUPAC Name: 4-butoxy-N-[4-[(2S)-2-pyridin-3-ylpiperidin-1-yl]sulfonylphenyl]benzamide Traditional Name: 4-butoxy-N-[4-[(2S)-2-(3-pyridyl)piperidino]sulfonylphenyl]benzamide Formula: C27H31N3O4S MolecularWeight: 493.61774

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3C4=CN=CC=C4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC[C@H]3C4=CN=CC=C4

InChI

InChI=1S/C27H31N3O4S/c1-2-3-19-34-24-13-9-21(10-14-24)27(31)29-23-11-15-25(16-12-23)35(32,33)30-18-5-4-8-26(30)22-7-6-17-28-20-22/h6-7,9-17,20,26H,2-5,8,18-19H2,1H3,(H,29,31)/t26-/m0/s1