N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-2-phenyl-butanamide

Systemtic Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-2-phenyl-butanamide Openeye Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-2-phenyl-butanamide CAS Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-2-thiazolyl]-2-phenylbutanamide IUPAC Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]-1,3-thiazol-2-yl]-2-phenylbutanamide Traditional Name: N-[4-[(6-methoxy-3,4-dihydro-1H-isoquinolin-2-yl)methyl]thiazol-2-yl]-2-phenyl-butyramide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=NC(=CS2)CN3CCC4=C(C3)C=CC(=C4)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=NC(=CS2)CN3CCC4=C(C3)C=CC(=C4)OC

InChI

InChI=1S/C24H27N3O2S/c1-3-22(17-7-5-4-6-8-17)23(28)26-24-25-20(16-30-24)15-27-12-11-18-13-21(29-2)10-9-19(18)14-27/h4-10,13,16,22H,3,11-12,14-15H2,1-2H3,(H,25,26,28)