N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-2-yl]-4-(pyrazol-1-ylmethyl)benzamide

Systemtic Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Openeye Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2,2-dimethyl-propyl]-4-(pyrazol-1-ylmethyl)benzamide CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-2-yl]-4-(1-pyrazolylmethyl)benzamide IUPAC Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-2-yl]-4-(pyrazol-1-ylmethyl)benzamide Traditional Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2,2-dimethyl-propyl]-4-(pyrazol-1-ylmethyl)benzamide Formula: C26H32N4O MolecularWeight: 416.55848

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1CCC2=CC=CC=C2C1)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CC(C)(C)C(CN1CCC2=CC=CC=C2C1)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C26H32N4O/c1-26(2,3)24(19-29-16-13-21-7-4-5-8-23(21)18-29)28-25(31)22-11-9-20(10-12-22)17-30-15-6-14-27-30/h4-12,14-15,24H,13,16-19H2,1-3H3,(H,28,31)