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

Systemtic Name: N-(2-dimethylaminoethyl)-2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(2-dimethylaminoethyl)-2-[[2-propanoyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]thiazole-4-carboxamide CAS Name: N-(2-dimethylaminoethyl)-2-[[1-(4-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-4-thiazolecarboxamide IUPAC Name: N-(2-dimethylaminoethyl)-2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(2-dimethylaminoethyl)-2-[[2-propionyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]thiazole-4-carboxamide Formula: C28H34N4O3S MolecularWeight: 506.65956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N4O3S/c1-5-26(33)32-14-12-20-10-11-22(16-23(20)27(32)21-8-6-19(2)7-9-21)35-17-25-30-24(18-36-25)28(34)29-13-15-31(3)4/h6-11,16,18,27H,5,12-15,17H2,1-4H3,(H,29,34)