N-[6-(4-chloranyl-2-cyclohexyl-phenoxy)pyridin-3-yl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide

Systemtic Name: N-[6-(4-chloranyl-2-cyclohexyl-phenoxy)pyridin-3-yl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide Openeye Name: N-[6-(4-chloro-2-cyclohexyl-phenoxy)-3-pyridyl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide CAS Name: N-[6-(4-chloro-2-cyclohexylphenoxy)-3-pyridinyl]-3-[(2-pyrazinylthio)methyl]benzamide IUPAC Name: N-[6-(4-chloro-2-cyclohexylphenoxy)pyridin-3-yl]-3-(pyrazin-2-ylsulfanylmethyl)benzamide Traditional Name: N-[6-(4-chloro-2-cyclohexyl-phenoxy)-3-pyridyl]-3-[(pyrazin-2-ylthio)methyl]benzamide Formula: C29H27ClN4O2S MolecularWeight: 531.06828

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=NC=C(C=C3)NC(=O)C4=CC(=CC=C4)CSC5=NC=CN=C5

Isomeric SMILES

C1CCC(CC1)C2=C(C=CC(=C2)Cl)OC3=NC=C(C=C3)NC(=O)C4=CC(=CC=C4)CSC5=NC=CN=C5

InChI

InChI=1S/C29H27ClN4O2S/c30-23-9-11-26(25(16-23)21-6-2-1-3-7-21)36-27-12-10-24(17-33-27)34-29(35)22-8-4-5-20(15-22)19-37-28-18-31-13-14-32-28/h4-5,8-18,21H,1-3,6-7,19H2,(H,34,35)