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

Systemtic Name: N-(phenylmethyl)-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-benzyl-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]thiazole-4-carboxamide CAS Name: 2-[[2-(1-oxopropyl)-1-phenyl-3,4-dihydro-1H-isoquinolin-7-yl]oxymethyl]-N-(phenylmethyl)-4-thiazolecarboxamide IUPAC Name: N-benzyl-2-[(1-phenyl-2-propanoyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-benzyl-2-[(1-phenyl-2-propionyl-3,4-dihydro-1H-isoquinolin-7-yl)oxymethyl]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=C2)OCC4=NC(=CS4)C(=O)NCC5=CC=CC=C5

Isomeric SMILES

CCC(=O)N1CCC2=C(C1C3=CC=CC=C3)C=C(C=C2)OCC4=NC(=CS4)C(=O)NCC5=CC=CC=C5

InChI

InChI=1S/C30H29N3O3S/c1-2-28(34)33-16-15-22-13-14-24(17-25(22)29(33)23-11-7-4-8-12-23)36-19-27-32-26(20-37-27)30(35)31-18-21-9-5-3-6-10-21/h3-14,17,20,29H,2,15-16,18-19H2,1H3,(H,31,35)