N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-(phenylmethyl)pyrazole-4-carboxamide

Systemtic Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]pyrazole-4-carboxamide CAS Name: N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[2-(3,4-dihydro-1H-isoquinolin-2-yl)butyl]pyrazole-4-carboxamide Formula: C24H28N4O MolecularWeight: 388.50532

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CNC(=O)C1=CN(N=C1)CC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCC(CNC(=O)C1=CN(N=C1)CC2=CC=CC=C2)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C24H28N4O/c1-2-23(27-13-12-20-10-6-7-11-21(20)17-27)15-25-24(29)22-14-26-28(18-22)16-19-8-4-3-5-9-19/h3-11,14,18,23H,2,12-13,15-17H2,1H3,(H,25,29)