N-(3-azanyl-3-oxidanylidene-2-thiophen-2-yl-propyl)-4-[(4-fluorophenyl)methoxy]-1-piperidin-4-ylcarbonyl-piperidine-2-carboxamide

Systemtic Name: N-(3-azanyl-3-oxidanylidene-2-thiophen-2-yl-propyl)-4-[(4-fluorophenyl)methoxy]-1-piperidin-4-ylcarbonyl-piperidine-2-carboxamide Openeye Name: N-[3-amino-3-oxo-2-(2-thienyl)propyl]-4-[(4-fluorophenyl)methoxy]-1-(piperidine-4-carbonyl)piperidine-2-carboxamide CAS Name: N-(3-amino-3-oxo-2-thiophen-2-ylpropyl)-4-[(4-fluorophenyl)methoxy]-1-[oxo(4-piperidinyl)methyl]-2-piperidinecarboxamide IUPAC Name: N-(3-amino-3-oxo-2-thiophen-2-ylpropyl)-4-[(4-fluorophenyl)methoxy]-1-(piperidine-4-carbonyl)piperidine-2-carboxamide Traditional Name: N-[3-amino-3-keto-2-(2-thienyl)propyl]-4-(4-fluorobenzyl)oxy-1-isonipecotoyl-pipecolinamide Formula: C26H33FN4O4S MolecularWeight: 516.628023

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1C(=O)N2CCC(CC2C(=O)NCC(C3=CC=CS3)C(=O)N)OCC4=CC=C(C=C4)F

Isomeric SMILES

C1CNCCC1C(=O)N2CCC(CC2C(=O)NCC(C3=CC=CS3)C(=O)N)OCC4=CC=C(C=C4)F

InChI

InChI=1S/C26H33FN4O4S/c27-19-5-3-17(4-6-19)16-35-20-9-12-31(26(34)18-7-10-29-11-8-18)22(14-20)25(33)30-15-21(24(28)32)23-2-1-13-36-23/h1-6,13,18,20-22,29H,7-12,14-16H2,(H2,28,32)(H,30,33)