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

Systemtic Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-isopropyl-N-methyl-thiazole-4-carboxamide CAS Name: 2-[[1-(4-fluorophenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-N-propan-2-yl-4-thiazolecarboxamide IUPAC Name: 2-[[1-(4-fluorophenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-methyl-N-propan-2-yl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[1-(4-fluorophenyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-isopropyl-N-methyl-thiazole-4-carboxamide Formula: C27H30FN3O3S MolecularWeight: 495.608803

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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)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(C)C(C)C

InChI

InChI=1S/C27H30FN3O3S/c1-5-25(32)31-13-12-18-8-11-21(14-22(18)26(31)19-6-9-20(28)10-7-19)34-15-24-29-23(16-35-24)27(33)30(4)17(2)3/h6-11,14,16-17,26H,5,12-13,15H2,1-4H3