1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-yl-ethyl]piperidine-4-carboxamide Openeye Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-[(2S)-2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-[(2S)-2-(1-pyrrolidinyl)-2-thiophen-2-ylethyl]-4-piperidinecarboxamide IUPAC Name: 1-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-[(2S)-2-pyrrolidin-1-yl-2-thiophen-2-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-[(2S)-2-pyrrolidino-2-(2-thienyl)ethyl]isonipecotamide Formula: C21H30N4O4S2 MolecularWeight: 466.6173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NCC(C3=CC=CS3)N4CCCC4

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCC(CC2)C(=O)NC[C@@H](C3=CC=CS3)N4CCCC4

InChI

InChI=1S/C21H30N4O4S2/c1-15-20(16(2)29-23-15)31(27,28)25-11-7-17(8-12-25)21(26)22-14-18(19-6-5-13-30-19)24-9-3-4-10-24/h5-6,13,17-18H,3-4,7-12,14H2,1-2H3,(H,22,26)/t18-/m0/s1