N-(2-chloranyl-4,6-dimethyl-phenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(2-chloranyl-4,6-dimethyl-phenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(2-chloro-4,6-dimethyl-phenyl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-(2-chloro-4,6-dimethylphenyl)-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(2-chloro-4,6-dimethylphenyl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(2-chloro-4,6-dimethyl-phenyl)-3-(4-piperidinosulfonylphenyl)propionamide Formula: C22H27ClN2O3S MolecularWeight: 434.97938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)CCC2=CC=C(C=C2)S(=O)(=O)N3CCCCC3)C

InChI

InChI=1S/C22H27ClN2O3S/c1-16-14-17(2)22(20(23)15-16)24-21(26)11-8-18-6-9-19(10-7-18)29(27,28)25-12-4-3-5-13-25/h6-7,9-10,14-15H,3-5,8,11-13H2,1-2H3,(H,24,26)