1-(1,3-benzoxazol-2-yl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]piperidine-4-carboxamide

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(dimethylamino)-2-thiophen-3-yl-ethyl]piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(dimethylamino)-2-(3-thiophenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(dimethylamino)-2-thiophen-3-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(dimethylamino)-2-(3-thienyl)ethyl]isonipecotamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3O2)C4=CSC=C4

Isomeric SMILES

CN(C)C(CNC(=O)C1CCN(CC1)C2=NC3=CC=CC=C3O2)C4=CSC=C4

InChI

InChI=1S/C21H26N4O2S/c1-24(2)18(16-9-12-28-14-16)13-22-20(26)15-7-10-25(11-8-15)21-23-17-5-3-4-6-19(17)27-21/h3-6,9,12,14-15,18H,7-8,10-11,13H2,1-2H3,(H,22,26)