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

Systemtic Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-isopropyl-thiazole-4-carboxamide CAS Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: N-ethyl-2-[[1-(4-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-isopropyl-thiazole-4-carboxamide Formula: C28H32FN3O3S MolecularWeight: 509.635383

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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(CC)C(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H32FN3O3S/c1-5-26(33)32-14-13-19-9-12-22(15-23(19)27(32)20-7-10-21(29)11-8-20)35-16-25-30-24(17-36-25)28(34)31(6-2)18(3)4/h7-12,15,17-18,27H,5-6,13-14,16H2,1-4H3