2-[[2-(3-methylbutanoyl)-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[2-(3-methylbutanoyl)-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[2-(3-methylbutanoyl)-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-thiazole-4-carboxamide CAS Name: 2-[[2-(3-methyl-1-oxobutyl)-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-4-thiazolecarboxamide IUPAC Name: 2-[[2-(3-methylbutanoyl)-1-(4-methylphenyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[2-isovaleryl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-thiazole-4-carboxamide Formula: C32H33N3O3S MolecularWeight: 539.68772

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)CC(C)C)C=CC(=C3)OCC4=NC(=CS4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2C3=C(CCN2C(=O)CC(C)C)C=CC(=C3)OCC4=NC(=CS4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C32H33N3O3S/c1-21(2)17-30(36)35-16-15-23-13-14-26(18-27(23)31(35)24-11-9-22(3)10-12-24)38-19-29-34-28(20-39-29)32(37)33-25-7-5-4-6-8-25/h4-14,18,20-21,31H,15-17,19H2,1-3H3,(H,33,37)