1-[2-[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[[(4-fluorophenyl)-thiophen-2-yl-methyl]amino]-2-oxidanylidene-ethyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Openeye Name: 1-[2-[[(4-fluorophenyl)-(2-thienyl)methyl]amino]-2-oxo-ethyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide CAS Name: 1-[2-[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl]-N-(2-methoxyphenyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[[(4-fluorophenyl)-thiophen-2-ylmethyl]amino]-2-oxoethyl]-N-(2-methoxyphenyl)piperidine-4-carboxamide Traditional Name: 1-[2-[[(4-fluorophenyl)-(2-thienyl)methyl]amino]-2-keto-ethyl]-N-(2-methoxyphenyl)isonipecotamide Formula: C26H28FN3O3S MolecularWeight: 481.582223

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CCN(CC2)CC(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CCN(CC2)CC(=O)NC(C3=CC=C(C=C3)F)C4=CC=CS4

InChI

InChI=1S/C26H28FN3O3S/c1-33-22-6-3-2-5-21(22)28-26(32)19-12-14-30(15-13-19)17-24(31)29-25(23-7-4-16-34-23)18-8-10-20(27)11-9-18/h2-11,16,19,25H,12-15,17H2,1H3,(H,28,32)(H,29,31)