1-(4-fluorophenyl)carbonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: 1-(4-fluorophenyl)carbonyl-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-(4-fluorobenzoyl)-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-1-(4-fluorobenzoyl)-N-(4-methyl-1,3-benzothiazol-2-yl)piperidine-4-carboxamide Traditional Name: N-benzyl-1-(4-fluorobenzoyl)-N-(4-methyl-1,3-benzothiazol-2-yl)isonipecotamide Formula: C28H26FN3O2S MolecularWeight: 487.588343

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)C4CCN(CC4)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H26FN3O2S/c1-19-6-5-9-24-25(19)30-28(35-24)32(18-20-7-3-2-4-8-20)27(34)22-14-16-31(17-15-22)26(33)21-10-12-23(29)13-11-21/h2-13,22H,14-18H2,1H3