5-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]-2-pyridin-4-yl-benzamide

Systemtic Name: 5-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]-2-pyridin-4-yl-benzamide Openeye Name: 5-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]-2-(4-pyridyl)benzamide CAS Name: 5-[3-cyclopentyloxy-4-methoxy-N-(3-pyridinylmethyl)anilino]-2-pyridin-4-ylbenzamide IUPAC Name: 5-[3-cyclopentyloxy-4-methoxy-N-(pyridin-3-ylmethyl)anilino]-2-pyridin-4-ylbenzamide Traditional Name: 5-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]-2-(4-pyridyl)benzamide Formula: C30H30N4O3 MolecularWeight: 494.5842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC(=C(C=C3)C4=CC=NC=C4)C(=O)N)OC5CCCC5

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC2=CN=CC=C2)C3=CC(=C(C=C3)C4=CC=NC=C4)C(=O)N)OC5CCCC5

InChI

InChI=1S/C30H30N4O3/c1-36-28-11-9-24(18-29(28)37-25-6-2-3-7-25)34(20-21-5-4-14-33-19-21)23-8-10-26(27(17-23)30(31)35)22-12-15-32-16-13-22/h4-5,8-19,25H,2-3,6-7,20H2,1H3,(H2,31,35)