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

Systemtic Name: N-[2-[3-(3-chloranyl-4-methoxy-phenyl)-5-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-benzamide Openeye Name: N-[2-[3-(3-chloro-4-methoxy-phenyl)-5-(4-pyridyl)-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-benzamide CAS Name: N-[2-[3-(3-chloro-4-methoxyphenyl)-5-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentylbenzamide IUPAC Name: N-[2-[3-(3-chloro-4-methoxyphenyl)-5-pyridin-4-yl-1,2,4-triazol-1-yl]ethyl]-N-cyclopentylbenzamide Traditional Name: N-[2-[3-(3-chloro-4-methoxy-phenyl)-5-(4-pyridyl)-1,2,4-triazol-1-yl]ethyl]-N-cyclopentyl-benzamide Formula: C28H28ClN5O2 MolecularWeight: 502.00722

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C(=N2)C3=CC=NC=C3)CCN(C4CCCC4)C(=O)C5=CC=CC=C5)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C(=N2)C3=CC=NC=C3)CCN(C4CCCC4)C(=O)C5=CC=CC=C5)Cl

InChI

InChI=1S/C28H28ClN5O2/c1-36-25-12-11-22(19-24(25)29)26-31-27(20-13-15-30-16-14-20)34(32-26)18-17-33(23-9-5-6-10-23)28(35)21-7-3-2-4-8-21/h2-4,7-8,11-16,19,23H,5-6,9-10,17-18H2,1H3