N,N-dibutyl-1-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-5-methyl-pyrazole-3-carboxamide

Systemtic Name: N,N-dibutyl-1-[2-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]-5-methyl-pyrazole-3-carboxamide Openeye Name: N,N-dibutyl-1-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-5-methyl-pyrazole-3-carboxamide CAS Name: N,N-dibutyl-1-[2-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]-5-methyl-3-pyrazolecarboxamide IUPAC Name: N,N-dibutyl-1-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-5-methylpyrazole-3-carboxamide Traditional Name: N,N-dibutyl-1-[2-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]-5-methyl-pyrazole-3-carboxamide Formula: C29H36N4O2 MolecularWeight: 472.62174

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C(=O)C1=NN(C(=C1)C)C2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCCCN(CCCC)C(=O)C1=NN(C(=C1)C)C2=CC=CC=C2C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C29H36N4O2/c1-4-6-17-31(18-7-5-2)29(35)26-20-22(3)33(30-26)27-15-11-10-14-25(27)28(34)32-19-16-23-12-8-9-13-24(23)21-32/h8-15,20H,4-7,16-19,21H2,1-3H3