N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide

Systemtic Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]-1,3-thiazol-2-yl]-2-phenyl-ethanamide Openeye Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]thiazol-2-yl]-2-phenyl-acetamide CAS Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-2-thiazolyl]-2-phenylacetamide IUPAC Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]-1,3-thiazol-2-yl]-2-phenylacetamide Traditional Name: N-[4-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thiazol-2-yl]-2-phenyl-acetamide Formula: C22H21N3O2S MolecularWeight: 391.48604

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CC3=CSC(=N3)NC(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CC3=CSC(=N3)NC(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H21N3O2S/c26-20(12-16-6-2-1-3-7-16)24-22-23-19(15-28-22)13-21(27)25-11-10-17-8-4-5-9-18(17)14-25/h1-9,15H,10-14H2,(H,23,24,26)