N-[3-[3-(2-naphthalen-1-ylethanoylamino)-1H-pyrazol-5-yl]cyclobutyl]quinoline-2-carboxamide

Systemtic Name: N-[3-[3-(2-naphthalen-1-ylethanoylamino)-1H-pyrazol-5-yl]cyclobutyl]quinoline-2-carboxamide Openeye Name: N-[3-[3-[[2-(1-naphthyl)acetyl]amino]-1H-pyrazol-5-yl]cyclobutyl]quinoline-2-carboxamide CAS Name: N-[3-[3-[[2-(1-naphthalenyl)-1-oxoethyl]amino]-1H-pyrazol-5-yl]cyclobutyl]-2-quinolinecarboxamide IUPAC Name: N-[3-[3-[(2-naphthalen-1-ylacetyl)amino]-1H-pyrazol-5-yl]cyclobutyl]quinoline-2-carboxamide Traditional Name: N-[3-[3-[[2-(1-naphthyl)acetyl]amino]-1H-pyrazol-5-yl]cyclobutyl]quinaldamide Formula: C29H25N5O2 MolecularWeight: 475.5411

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC1NC(=O)C2=NC3=CC=CC=C3C=C2)C4=CC(=NN4)NC(=O)CC5=CC=CC6=CC=CC=C65

Isomeric SMILES

C1C(CC1NC(=O)C2=NC3=CC=CC=C3C=C2)C4=CC(=NN4)NC(=O)CC5=CC=CC6=CC=CC=C65

InChI

InChI=1S/C29H25N5O2/c35-28(16-20-9-5-8-18-6-1-3-10-23(18)20)32-27-17-26(33-34-27)21-14-22(15-21)30-29(36)25-13-12-19-7-2-4-11-24(19)31-25/h1-13,17,21-22H,14-16H2,(H,30,36)(H2,32,33,34,35)