N-[2-[5-(3-chloranyl-4-methoxy-phenyl)-3-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-quinoline-4-carboxamide

Systemtic Name: N-[2-[5-(3-chloranyl-4-methoxy-phenyl)-3-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-quinoline-4-carboxamide Openeye Name: N-[2-[5-(3-chloro-4-methoxy-phenyl)-3-(4-pyridyl)-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-quinoline-4-carboxamide CAS Name: N-[2-[5-(3-chloro-4-methoxyphenyl)-3-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-4-quinolinecarboxamide IUPAC Name: N-[2-[5-(3-chloro-4-methoxyphenyl)-3-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentylquinoline-4-carboxamide Traditional Name: N-[2-[5-(3-chloro-4-methoxy-phenyl)-3-(4-pyridyl)-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-cinchoninamide Formula: C31H29ClN6O2 MolecularWeight: 553.05396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC(=NN2CCN(C3CCCC3)C(=O)C4=CC=NC5=CC=CC=C45)C6=CC=NC=C6)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC(=NN2CCN(C3CCCC3)C(=O)C4=CC=NC5=CC=CC=C45)C6=CC=NC=C6)Cl

InChI

InChI=1S/C31H29ClN6O2/c1-40-28-11-10-22(20-26(28)32)30-35-29(21-12-15-33-16-13-21)36-38(30)19-18-37(23-6-2-3-7-23)31(39)25-14-17-34-27-9-5-4-8-24(25)27/h4-5,8-17,20,23H,2-3,6-7,18-19H2,1H3