N-[(2R)-3-methyl-2-morpholin-4-yl-butyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[(2R)-3-methyl-2-morpholin-4-yl-butyl]-1-(4-methylphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[(2R)-3-methyl-2-morpholino-butyl]-1-(p-tolylsulfonyl)piperidine-4-carboxamide CAS Name: N-[(2R)-3-methyl-2-(4-morpholinyl)butyl]-1-(4-methylphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[(2R)-3-methyl-2-morpholin-4-ylbutyl]-1-(4-methylphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[(2R)-3-methyl-2-morpholino-butyl]-1-tosyl-isonipecotamide Formula: C22H35N3O4S MolecularWeight: 437.596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC(C(C)C)N3CCOCC3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC[C@@H](C(C)C)N3CCOCC3

InChI

InChI=1S/C22H35N3O4S/c1-17(2)21(24-12-14-29-15-13-24)16-23-22(26)19-8-10-25(11-9-19)30(27,28)20-6-4-18(3)5-7-20/h4-7,17,19,21H,8-16H2,1-3H3,(H,23,26)/t21-/m0/s1