2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(4-tert-butylphenyl)methyl-[(4-fluorophenyl)methyl]amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-tert-butylbenzyl)-(4-fluorobenzyl)amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C26H32FN3OS MolecularWeight: 453.615183

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)CN(CC2=CC=C(C=C2)C(C)(C)C)CC3=CC=C(C=C3)F

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)CN(CC2=CC=C(C=C2)C(C)(C)C)CC3=CC=C(C=C3)F

InChI

InChI=1S/C26H32FN3OS/c1-5-14-28-25(31)23-18-32-24(29-23)17-30(16-20-8-12-22(27)13-9-20)15-19-6-10-21(11-7-19)26(2,3)4/h6-13,18H,5,14-17H2,1-4H3,(H,28,31)