tert-butyl 4-[[4-azanyl-5-(3-fluorophenyl)carbonyl-1,3-thiazol-2-yl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[4-azanyl-5-(3-fluorophenyl)carbonyl-1,3-thiazol-2-yl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[4-amino-5-(3-fluorobenzoyl)thiazol-2-yl]amino]piperidine-1-carboxylate CAS Name: 4-[[4-amino-5-[(3-fluorophenyl)-oxomethyl]-2-thiazolyl]amino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[4-amino-5-(3-fluorobenzoyl)-1,3-thiazol-2-yl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-amino-5-(3-fluorobenzoyl)thiazol-2-yl]amino]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H25FN4O3S MolecularWeight: 420.500903

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)NC2=NC(=C(S2)C(=O)C3=CC(=CC=C3)F)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)NC2=NC(=C(S2)C(=O)C3=CC(=CC=C3)F)N

InChI

InChI=1S/C20H25FN4O3S/c1-20(2,3)28-19(27)25-9-7-14(8-10-25)23-18-24-17(22)16(29-18)15(26)12-5-4-6-13(21)11-12/h4-6,11,14H,7-10,22H2,1-3H3,(H,23,24)