N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-1,3-thiazole-4-carboxamide

Systemtic Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-1,3-thiazole-4-carboxamide Openeye Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-thiazole-4-carboxamide CAS Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-4-thiazolecarboxamide IUPAC Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-1,3-thiazole-4-carboxamide Traditional Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-thiazole-4-carboxamide Formula: C26H28FN3O3S MolecularWeight: 481.582223

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC4=NC(=CS4)C(=O)N(C)CC

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)F)C=C(C=C2)OCC4=NC(=CS4)C(=O)N(C)CC

InChI

InChI=1S/C26H28FN3O3S/c1-4-24(31)30-13-12-17-8-11-20(14-21(17)25(30)18-6-9-19(27)10-7-18)33-15-23-28-22(16-34-23)26(32)29(3)5-2/h6-11,14,16,25H,4-5,12-13,15H2,1-3H3