4-[4-chloranyl-2-[2-(cyclohexylamino)pyridin-4-yl]-5-phenylmethoxy-thiophen-3-yl]-N-methyl-benzamide

Systemtic Name: 4-[4-chloranyl-2-[2-(cyclohexylamino)pyridin-4-yl]-5-phenylmethoxy-thiophen-3-yl]-N-methyl-benzamide Openeye Name: 4-[5-benzyloxy-4-chloro-2-[2-(cyclohexylamino)-4-pyridyl]-3-thienyl]-N-methyl-benzamide CAS Name: 4-[4-chloro-2-[2-(cyclohexylamino)-4-pyridinyl]-5-phenylmethoxy-3-thiophenyl]-N-methylbenzamide IUPAC Name: 4-[4-chloro-2-[2-(cyclohexylamino)pyridin-4-yl]-5-phenylmethoxythiophen-3-yl]-N-methylbenzamide Traditional Name: 4-[5-benzoxy-4-chloro-2-[2-(cyclohexylamino)-4-pyridyl]-3-thienyl]-N-methyl-benzamide Formula: C30H30ClN3O2S MolecularWeight: 532.0961

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC=C(C=C1)C2=C(SC(=C2Cl)OCC3=CC=CC=C3)C4=CC(=NC=C4)NC5CCCCC5

Isomeric SMILES

CNC(=O)C1=CC=C(C=C1)C2=C(SC(=C2Cl)OCC3=CC=CC=C3)C4=CC(=NC=C4)NC5CCCCC5

InChI

InChI=1S/C30H30ClN3O2S/c1-32-29(35)22-14-12-21(13-15-22)26-27(31)30(36-19-20-8-4-2-5-9-20)37-28(26)23-16-17-33-25(18-23)34-24-10-6-3-7-11-24/h2,4-5,8-9,12-18,24H,3,6-7,10-11,19H2,1H3,(H,32,35)(H,33,34)