4-[[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]methylsulfanyl]-N-(2-methylbutyl)benzamide

Systemtic Name: 4-[[2-(2-imidazol-1-yl-1-phenyl-ethoxy)-5-oxidanylidene-7,8-dihydro-6H-naphthalen-1-yl]methylsulfanyl]-N-(2-methylbutyl)benzamide Openeye Name: 4-[[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-oxo-tetralin-5-yl]methylsulfanyl]-N-(2-methylbutyl)benzamide CAS Name: 4-[[2-[2-(1-imidazolyl)-1-phenylethoxy]-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methylthio]-N-(2-methylbutyl)benzamide IUPAC Name: 4-[[2-(2-imidazol-1-yl-1-phenylethoxy)-5-oxo-7,8-dihydro-6H-naphthalen-1-yl]methylsulfanyl]-N-(2-methylbutyl)benzamide Traditional Name: 4-[[6-(2-imidazol-1-yl-1-phenyl-ethoxy)-1-keto-tetralin-5-yl]methylthio]-N-(2-methylbutyl)benzamide Formula: C34H37N3O3S MolecularWeight: 567.74088

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CNC(=O)C1=CC=C(C=C1)SCC2=C(C=CC3=C2CCCC3=O)OC(CN4C=CN=C4)C5=CC=CC=C5

Isomeric SMILES

CCC(C)CNC(=O)C1=CC=C(C=C1)SCC2=C(C=CC3=C2CCCC3=O)OC(CN4C=CN=C4)C5=CC=CC=C5

InChI

InChI=1S/C34H37N3O3S/c1-3-24(2)20-36-34(39)26-12-14-27(15-13-26)41-22-30-28-10-7-11-31(38)29(28)16-17-32(30)40-33(21-37-19-18-35-23-37)25-8-5-4-6-9-25/h4-6,8-9,12-19,23-24,33H,3,7,10-11,20-22H2,1-2H3,(H,36,39)