N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide

Systemtic Name: N-(4-chloranyl-3-piperidin-1-ylsulfonyl-phenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide Openeye Name: N-[4-chloro-3-(1-piperidylsulfonyl)phenyl]-1-(2-methylpropanoyl)piperidine-4-carboxamide CAS Name: N-[4-chloro-3-(1-piperidinylsulfonyl)phenyl]-1-(2-methyl-1-oxopropyl)-4-piperidinecarboxamide IUPAC Name: N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide Traditional Name: N-(4-chloro-3-piperidinosulfonyl-phenyl)-1-isobutyryl-isonipecotamide Formula: C21H30ClN3O4S MolecularWeight: 455.9986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)C(=O)NC2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C21H30ClN3O4S/c1-15(2)21(27)24-12-8-16(9-13-24)20(26)23-17-6-7-18(22)19(14-17)30(28,29)25-10-4-3-5-11-25/h6-7,14-16H,3-5,8-13H2,1-2H3,(H,23,26)