N-(3-chloranyl-4-pyridin-2-ylsulfanyl-phenyl)-2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]benzamide

Systemtic Name: N-(3-chloranyl-4-pyridin-2-ylsulfanyl-phenyl)-2-[(5-methyl-2-propan-2-yl-phenoxy)methyl]benzamide Openeye Name: N-[3-chloro-4-(2-pyridylsulfanyl)phenyl]-2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzamide CAS Name: N-[3-chloro-4-(2-pyridinylthio)phenyl]-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]benzamide IUPAC Name: N-(3-chloro-4-pyridin-2-ylsulfanylphenyl)-2-[(5-methyl-2-propan-2-ylphenoxy)methyl]benzamide Traditional Name: N-[3-chloro-4-(2-pyridylthio)phenyl]-2-[(2-isopropyl-5-methyl-phenoxy)methyl]benzamide Formula: C29H27ClN2O2S MolecularWeight: 503.05488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(C)C)OCC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)SC4=CC=CC=N4)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(C)C)OCC2=CC=CC=C2C(=O)NC3=CC(=C(C=C3)SC4=CC=CC=N4)Cl

InChI

InChI=1S/C29H27ClN2O2S/c1-19(2)23-13-11-20(3)16-26(23)34-18-21-8-4-5-9-24(21)29(33)32-22-12-14-27(25(30)17-22)35-28-10-6-7-15-31-28/h4-17,19H,18H2,1-3H3,(H,32,33)