5-[3-(dimethylamino)propoxy]-2-(phenylmethyl)-N-quinolin-3-yl-pyrazole-3-carboxamide

Systemtic Name: 5-[3-(dimethylamino)propoxy]-2-(phenylmethyl)-N-quinolin-3-yl-pyrazole-3-carboxamide Openeye Name: 2-benzyl-5-[3-(dimethylamino)propoxy]-N-(3-quinolyl)pyrazole-3-carboxamide CAS Name: 5-[3-(dimethylamino)propoxy]-2-(phenylmethyl)-N-(3-quinolinyl)-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-5-[3-(dimethylamino)propoxy]-N-quinolin-3-ylpyrazole-3-carboxamide Traditional Name: 2-benzyl-5-[3-(dimethylamino)propoxy]-N-(3-quinolyl)pyrazole-3-carboxamide Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCOC1=NN(C(=C1)C(=O)NC2=CC3=CC=CC=C3N=C2)CC4=CC=CC=C4

Isomeric SMILES

CN(C)CCCOC1=NN(C(=C1)C(=O)NC2=CC3=CC=CC=C3N=C2)CC4=CC=CC=C4

InChI

InChI=1S/C25H27N5O2/c1-29(2)13-8-14-32-24-16-23(30(28-24)18-19-9-4-3-5-10-19)25(31)27-21-15-20-11-6-7-12-22(20)26-17-21/h3-7,9-12,15-17H,8,13-14,18H2,1-2H3,(H,27,31)