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

Systemtic Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-thiazol-2-yl]-2-phenyl-butanamide Openeye Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)thiazol-2-yl]-2-phenyl-butanamide CAS Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2-thiazolyl]-2-phenylbutanamide IUPAC Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-1,3-thiazol-2-yl]-2-phenylbutanamide Traditional Name: N-[4-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)thiazol-2-yl]-2-phenyl-butyramide Formula: C23H25N3OS MolecularWeight: 391.5291

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=NC(=CS2)CN3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=NC(=CS2)CN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H25N3OS/c1-2-21(18-9-4-3-5-10-18)22(27)25-23-24-20(16-28-23)15-26-13-12-17-8-6-7-11-19(17)14-26/h3-11,16,21H,2,12-15H2,1H3,(H,24,25,27)