N-[3-[[(4-azanylcyclohexyl)-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]thiophene-2-carboxamide

Systemtic Name: N-[3-[[(4-azanylcyclohexyl)-(3-fluorophenyl)carbonyl-amino]methyl]phenyl]thiophene-2-carboxamide Openeye Name: N-[3-[[(4-aminocyclohexyl)-(3-fluorobenzoyl)amino]methyl]phenyl]thiophene-2-carboxamide CAS Name: N-[3-[[(4-aminocyclohexyl)-[(3-fluorophenyl)-oxomethyl]amino]methyl]phenyl]-2-thiophenecarboxamide IUPAC Name: N-[3-[[(4-aminocyclohexyl)-(3-fluorobenzoyl)amino]methyl]phenyl]thiophene-2-carboxamide Traditional Name: N-[3-[[(4-aminocyclohexyl)-(3-fluorobenzoyl)amino]methyl]phenyl]thiophene-2-carboxamide Formula: C25H26FN3O2S MolecularWeight: 451.556243

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)C4=CC(=CC=C4)F

Isomeric SMILES

C1CC(CCC1N)N(CC2=CC(=CC=C2)NC(=O)C3=CC=CS3)C(=O)C4=CC(=CC=C4)F

InChI

InChI=1S/C25H26FN3O2S/c26-19-6-2-5-18(15-19)25(31)29(22-11-9-20(27)10-12-22)16-17-4-1-7-21(14-17)28-24(30)23-8-3-13-32-23/h1-8,13-15,20,22H,9-12,16,27H2,(H,28,30)