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

Systemtic Name: N-(2-methylpropyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-isobutyl-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]thiazole-4-carboxamide CAS Name: N-(2-methylpropyl)-2-[[2-(1-oxopropyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-4-thiazolecarboxamide IUPAC Name: N-(2-methylpropyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-isobutyl-2-[(1-phenyl-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]thiazole-4-carboxamide Formula: C27H31N3O3S MolecularWeight: 477.61834

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H31N3O3S/c1-4-25(31)30-13-12-19-10-11-21(14-22(19)26(30)20-8-6-5-7-9-20)33-16-24-29-23(17-34-24)27(32)28-15-18(2)3/h5-11,14,17-18,26H,4,12-13,15-16H2,1-3H3,(H,28,32)