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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CSC(=N1)COC2=CC3=C(CCN(C3C4=CC(=CC=C4)C)C(=O)CC)C=C2

Isomeric SMILES

CCCNC(=O)C1=CSC(=N1)COC2=CC3=C(CCN(C3C4=CC(=CC=C4)C)C(=O)CC)C=C2

InChI

InChI=1S/C27H31N3O3S/c1-4-12-28-27(32)23-17-34-24(29-23)16-33-21-10-9-19-11-13-30(25(31)5-2)26(22(19)15-21)20-8-6-7-18(3)14-20/h6-10,14-15,17,26H,4-5,11-13,16H2,1-3H3,(H,28,32)