(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid [3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: (3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid [3-(3-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C20H18N4O4S MolecularWeight: 410.44632

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=NC(=NO2)C3=CSC=C3)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=NC(=NO2)C3=CSC=C3)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C20H18N4O4S/c25-19(26-11-17-22-18(23-28-17)14-7-10-29-12-14)13-5-8-24(9-6-13)20-21-15-3-1-2-4-16(15)27-20/h1-4,7,10,12-13H,5-6,8-9,11H2