2-[[[2,4-bis(fluoranyl)phenyl]carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[[2,4-bis(fluoranyl)phenyl]carbamoyl-propyl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(2,4-difluorophenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[(2,4-difluoroanilino)-oxomethyl]-propylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(2,4-difluorophenyl)carbamoyl-propylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(2,4-difluorophenyl)carbamoyl-propyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C18H22F2N4O2S MolecularWeight: 396.454686

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)NC2=C(C=C(C=C2)F)F

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CCC)C(=O)NC2=C(C=C(C=C2)F)F

InChI

InChI=1S/C18H22F2N4O2S/c1-3-7-21-17(25)15-11-27-16(22-15)10-24(8-4-2)18(26)23-14-6-5-12(19)9-13(14)20/h5-6,9,11H,3-4,7-8,10H2,1-2H3,(H,21,25)(H,23,26)