N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-4-yl]-4-phenoxy-butanamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-4-yl]-4-phenoxy-butanamide Openeye Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)thiazol-4-yl]-4-phenoxy-butanamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-4-thiazolyl]-4-phenoxybutanamide IUPAC Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-thiazol-4-yl]-4-phenoxybutanamide Traditional Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)thiazol-4-yl]-4-phenoxy-butyramide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=NC(=CS3)NC(=O)CCCOC4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=NC(=CS3)NC(=O)CCCOC4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S/c26-21(11-6-14-27-19-9-2-1-3-10-19)23-20-16-28-22(24-20)25-13-12-17-7-4-5-8-18(17)15-25/h1-5,7-10,16H,6,11-15H2,(H,23,26)