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

Systemtic Name: 2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[2-propanoyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(2-pyrrolidin-1-ylethyl)thiazole-4-carboxamide CAS Name: 2-[[1-(4-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-[2-(1-pyrrolidinyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[[1-(4-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[2-propionyl-1-(p-tolyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(2-pyrrolidinoethyl)thiazole-4-carboxamide Formula: C30H36N4O3S MolecularWeight: 532.69684

Click to see the large picture

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)NCCN5CCCC5

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=C(C=C3)C)C=C(C=C2)OCC4=NC(=CS4)C(=O)NCCN5CCCC5

InChI

InChI=1S/C30H36N4O3S/c1-3-28(35)34-16-12-22-10-11-24(18-25(22)29(34)23-8-6-21(2)7-9-23)37-19-27-32-26(20-38-27)30(36)31-13-17-33-14-4-5-15-33/h6-11,18,20,29H,3-5,12-17,19H2,1-2H3,(H,31,36)