N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide Openeye Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-2-phenyl-acetamide CAS Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-thiazolyl]-2-phenylacetamide IUPAC Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-2-phenylacetamide Traditional Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-2-phenyl-acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(CN(CC2)CC3=CSC(=N3)NC(=O)CC4=CC=CC=C4)C=C1

Isomeric SMILES

COC1=CC2=C(CN(CC2)CC3=CSC(=N3)NC(=O)CC4=CC=CC=C4)C=C1

InChI

InChI=1S/C22H23N3O2S/c1-27-20-8-7-18-13-25(10-9-17(18)12-20)14-19-15-28-22(23-19)24-21(26)11-16-5-3-2-4-6-16/h2-8,12,15H,9-11,13-14H2,1H3,(H,23,24,26)