3-(3-chloranyl-4-methyl-phenyl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]propanamide

Systemtic Name: 3-(3-chloranyl-4-methyl-phenyl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]propanamide Openeye Name: 3-(3-chloro-4-methyl-phenyl)-N-[[2-(1-piperidylsulfonyl)phenyl]methyl]propanamide CAS Name: 3-(3-chloro-4-methylphenyl)-N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]propanamide IUPAC Name: 3-(3-chloro-4-methylphenyl)-N-[(2-piperidin-1-ylsulfonylphenyl)methyl]propanamide Traditional Name: 3-(3-chloro-4-methyl-phenyl)-N-(2-piperidinosulfonylbenzyl)propionamide Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CCC(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)CCC(=O)NCC2=CC=CC=C2S(=O)(=O)N3CCCCC3)Cl

InChI

InChI=1S/C22H27ClN2O3S/c1-17-9-10-18(15-20(17)23)11-12-22(26)24-16-19-7-3-4-8-21(19)29(27,28)25-13-5-2-6-14-25/h3-4,7-10,15H,2,5-6,11-14,16H2,1H3,(H,24,26)