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

Systemtic Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(diethylamino)-2-thiophen-3-yl-ethyl]piperidine-4-carboxamide Openeye Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(diethylamino)-2-(3-thienyl)ethyl]piperidine-4-carboxamide CAS Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(diethylamino)-2-(3-thiophenyl)ethyl]-4-piperidinecarboxamide IUPAC Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(diethylamino)-2-thiophen-3-ylethyl]piperidine-4-carboxamide Traditional Name: 1-(1,3-benzoxazol-2-yl)-N-[2-(diethylamino)-2-(3-thienyl)ethyl]isonipecotamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O2S/c1-3-26(4-2)20(18-11-14-30-16-18)15-24-22(28)17-9-12-27(13-10-17)23-25-19-7-5-6-8-21(19)29-23/h5-8,11,14,16-17,20H,3-4,9-10,12-13,15H2,1-2H3,(H,24,28)