N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-(2,4-dimethylphenyl)sulfonyl-N-propyl-piperidine-4-carboxamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-1-(2,4-dimethylphenyl)sulfonyl-N-propyl-piperidine-4-carboxamide Openeye Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(3S)-1,1-dioxothiolan-3-yl]-N-propyl-piperidine-4-carboxamide CAS Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-propyl-4-piperidinecarboxamide IUPAC Name: 1-(2,4-dimethylphenyl)sulfonyl-N-[(3S)-1,1-dioxothiolan-3-yl]-N-propylpiperidine-4-carboxamide Traditional Name: N-[(3S)-1,1-diketothiolan-3-yl]-1-(2,4-dimethylphenyl)sulfonyl-N-propyl-isonipecotamide Formula: C21H32N2O5S2 MolecularWeight: 456.61918

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

Isomeric SMILES

CCCN([C@H]1CCS(=O)(=O)C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=C(C=C(C=C3)C)C

InChI

InChI=1S/C21H32N2O5S2/c1-4-10-23(19-9-13-29(25,26)15-19)21(24)18-7-11-22(12-8-18)30(27,28)20-6-5-16(2)14-17(20)3/h5-6,14,18-19H,4,7-13,15H2,1-3H3/t19-/m0/s1