2-(4-pyrazol-1-ylphenyl)-N-(quinolin-8-ylmethyl)ethanamine

Systemtic Name: 2-(4-pyrazol-1-ylphenyl)-N-(quinolin-8-ylmethyl)ethanamine Openeye Name: 2-(4-pyrazol-1-ylphenyl)-N-(8-quinolylmethyl)ethanamine CAS Name: 2-[4-(1-pyrazolyl)phenyl]-N-(8-quinolinylmethyl)ethanamine IUPAC Name: 2-(4-pyrazol-1-ylphenyl)-N-(quinolin-8-ylmethyl)ethanamine Traditional Name: 2-(4-pyrazol-1-ylphenyl)ethyl-(8-quinolylmethyl)amine Formula: C21H20N4 MolecularWeight: 328.4103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CNCCC3=CC=C(C=C3)N4C=CC=N4)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CNCCC3=CC=C(C=C3)N4C=CC=N4)N=CC=C2

InChI

InChI=1S/C21H20N4/c1-4-18-6-2-12-23-21(18)19(5-1)16-22-14-11-17-7-9-20(10-8-17)25-15-3-13-24-25/h1-10,12-13,15,22H,11,14,16H2