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

Systemtic Name: 2-[[1-(3-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[1-(m-tolyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-thiazole-4-carboxamide CAS Name: 2-[[1-(3-methylphenyl)-2-(1-oxopropyl)-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-4-thiazolecarboxamide IUPAC Name: 2-[[1-(3-methylphenyl)-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[1-(m-tolyl)-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-phenyl-thiazole-4-carboxamide Formula: C30H29N3O3S MolecularWeight: 511.63456

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1CCC2=C(C1C3=CC(=CC=C3)C)C=C(C=C2)OCC4=NC(=CS4)C(=O)NC5=CC=CC=C5

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC(=CC=C3)C)C=C(C=C2)OCC4=NC(=CS4)C(=O)NC5=CC=CC=C5

InChI

InChI=1S/C30H29N3O3S/c1-3-28(34)33-15-14-21-12-13-24(17-25(21)29(33)22-9-7-8-20(2)16-22)36-18-27-32-26(19-37-27)30(35)31-23-10-5-4-6-11-23/h4-13,16-17,19,29H,3,14-15,18H2,1-2H3,(H,31,35)