1-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide

Systemtic Name: 1-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide Openeye Name: 1-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoyl]-N-thiazol-2-yl-piperidine-4-carboxamide CAS Name: 1-[2-[[[(4-fluorophenyl)methylamino]-oxomethyl]amino]-1-oxopentyl]-N-(2-thiazolyl)-4-piperidinecarboxamide IUPAC Name: 1-[2-[(4-fluorophenyl)methylcarbamoylamino]pentanoyl]-N-(1,3-thiazol-2-yl)piperidine-4-carboxamide Traditional Name: 1-[2-[(4-fluorobenzyl)carbamoylamino]pentanoyl]-N-thiazol-2-yl-isonipecotamide Formula: C22H28FN5O3S MolecularWeight: 461.552823

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)N1CCC(CC1)C(=O)NC2=NC=CS2)NC(=O)NCC3=CC=C(C=C3)F

Isomeric SMILES

CCCC(C(=O)N1CCC(CC1)C(=O)NC2=NC=CS2)NC(=O)NCC3=CC=C(C=C3)F

InChI

InChI=1S/C22H28FN5O3S/c1-2-3-18(26-21(31)25-14-15-4-6-17(23)7-5-15)20(30)28-11-8-16(9-12-28)19(29)27-22-24-10-13-32-22/h4-7,10,13,16,18H,2-3,8-9,11-12,14H2,1H3,(H,24,27,29)(H2,25,26,31)